# systems

unique_id: dc778617e889aec91a242beec3b1180b
username: dulak
calculator: aims
data: null
calculator_parameters:
[cell repeats an earlier one in this file: 2964 characters]

key_value_pairs:
  {"name": "isobutane", "basis": "aug-cc-pV5Z", "relativistic": 0.0, "relaxed": false, "calculator_version": 81213.0, "project": "g2", "time": 2429.1521089076996, "bsse_corrected": 0.0}


unique_id: cf00f7af65433a460258fc6aa35f176b
username: dulak
calculator: aims
data: null
calculator_parameters:
[cell repeats an earlier one in this file: 2964 characters]

key_value_pairs:
  {"name": "C5H8", "basis": "aug-cc-pV5Z", "relativistic": 0.0, "relaxed": false, "calculator_version": 81213.0, "project": "g2", "time": 2608.7874360084534, "bsse_corrected": 0.0}


unique_id: 59438f1451051d2a5f7997f0e408be26
username: dulak
calculator: aims
data: null
calculator_parameters:
[cell repeats an earlier one in this file: 2964 characters]

key_value_pairs:
  {"name": "2-butyne", "basis": "aug-cc-pV5Z", "relativistic": 0.0, "relaxed": true, "calculator_version": 81213.0, "project": "g2", "time": 8747.9004139900208, "bsse_corrected": 0.0}


unique_id: 5bbde514ccc34e27f2944d4527ced83b
username: dulak
calculator: aims
data: null
calculator_parameters:
[cell repeats an earlier one in this file: 2964 characters]

key_value_pairs:
  {"name": "C6H6", "basis": "aug-cc-pV5Z", "relativistic": 0.0, "relaxed": false, "calculator_version": 81213.0, "project": "g2", "time": 2057.5785400867462, "bsse_corrected": 0.0}


unique_id: b104c5733ffff2741b5a6101d725a1ed
username: dulak
calculator: aims
data: null
calculator_parameters:
[cell repeats an earlier one in this file: 2964 characters]

key_value_pairs:
  {"name": "cyclobutene", "basis": "aug-cc-pV5Z", "relativistic": 0.0, "relaxed": true, "calculator_version": 81213.0, "project": "g2", "time": 12088.124053001404, "bsse_corrected": 0.0}


unique_id: beb42070b54192a2c1f9565e1c9981d6
username: dulak
calculator: aims
data: null
calculator_parameters:
[cell repeats an earlier one in this file: 2964 characters]

key_value_pairs:
  {"name": "methylenecyclopropane", "basis": "aug-cc-pV5Z", "relativistic": 0.0, "relaxed": true, "calculator_version": 81213.0, "project": "g2", "time": 12628.557585954666, "bsse_corrected": 0.0}


unique_id: 2ad8ecbab4ff9cac51b69e45f79ad92b
username: dulak
calculator: aims
data: null
calculator_parameters:
[cell repeats an earlier one in this file: 2964 characters]

key_value_pairs:
  {"name": "H2CF2", "basis": "aug-cc-pV5Z", "relativistic": 0.0, "relaxed": false, "calculator_version": 81213.0, "project": "g2", "time": 321.69034910202026, "bsse_corrected": 0.0}


unique_id: dde680135ff35cabf10da4f473607cf1
username: dulak
calculator: aims
data: null
calculator_parameters:
[cell repeats an earlier one in this file: 2964 characters]

key_value_pairs:
  {"name": "C3H6_Cs", "basis": "aug-cc-pV5Z", "relativistic": 0.0, "relaxed": true, "calculator_version": 81213.0, "project": "g2", "time": 16764.15656208992, "bsse_corrected": 0.0}


unique_id: 3d14ff3d08acbb78f055edda1fa7f847
username: dulak
calculator: aims
data: null
calculator_parameters:
[cell repeats an earlier one in this file: 2964 characters]

key_value_pairs:
  {"name": "HCF3", "basis": "aug-cc-pV5Z", "relativistic": 0.0, "relaxed": false, "calculator_version": 81213.0, "project": "g2", "time": 359.62202978134155, "bsse_corrected": 0.0}


unique_id: 1aeeff2bdd35423c2c3c4d30d19563b8
username: dulak
calculator: aims
data: null
calculator_parameters:
[cell repeats an earlier one in this file: 2964 characters]

key_value_pairs:
  {"name": "H2CCl2", "basis": "aug-cc-pV5Z", "relativistic": 0.0, "relaxed": false, "calculator_version": 81213.0, "project": "g2", "time": 518.43192386627197, "bsse_corrected": 0.0}


unique_id: e8055adaeb3eb91ba37c05b3e4477d57
username: dulak
calculator: aims
data: null
calculator_parameters:
[cell repeats an earlier one in this file: 2964 characters]

key_value_pairs:
  {"name": "HCF3", "basis": "aug-cc-pV5Z", "relativistic": 0.0, "relaxed": true, "calculator_version": 81213.0, "project": "g2", "time": 1457.4378848075867, "bsse_corrected": 0.0}


unique_id: dd209c44a670e013c2902b5f375da993
username: dulak
calculator: aims
data: null
calculator_parameters:
[cell repeats an earlier one in this file: 2964 characters]

key_value_pairs:
  {"name": "HCCl3", "basis": "aug-cc-pV5Z", "relativistic": 0.0, "relaxed": false, "calculator_version": 81213.0, "project": "g2", "time": 611.64120388031006, "bsse_corrected": 0.0}


unique_id: 850e384cb5aadc8e6d772e3001dc5190
username: dulak
calculator: aims
data: null
calculator_parameters:
[cell repeats an earlier one in this file: 2964 characters]

key_value_pairs:
  {"name": "H2CF2", "basis": "aug-cc-pV5Z", "relativistic": 0.0, "relaxed": true, "calculator_version": 81213.0, "project": "g2", "time": 2779.0809488296509, "bsse_corrected": 0.0}


unique_id: 99853f102043b485f7d6a1ba7ed86272
username: dulak
calculator: aims
data: null
calculator_parameters:
[cell repeats an earlier one in this file: 2964 characters]

key_value_pairs:
  {"name": "butadiene", "basis": "aug-cc-pV5Z", "relativistic": 0.0, "relaxed": true, "calculator_version": 81213.0, "project": "g2", "time": 16456.044513940811, "bsse_corrected": 0.0}


unique_id: ec03b88182fd926293ba2e6bc1f006b2
username: dulak
calculator: aims
data: null
calculator_parameters:
[cell repeats an earlier one in this file: 2964 characters]

key_value_pairs:
  {"name": "H3CNH2", "basis": "aug-cc-pV5Z", "relativistic": 0.0, "relaxed": false, "calculator_version": 81213.0, "project": "g2", "time": 527.19098091125488, "bsse_corrected": 0.0}


unique_id: 2bf85ac1fd799ef10bc94d8b5dd854e6
username: dulak
calculator: aims
data: null
calculator_parameters:
[cell repeats an earlier one in this file: 2964 characters]

key_value_pairs:
  {"name": "CH3CN", "basis": "aug-cc-pV5Z", "relativistic": 0.0, "relaxed": false, "calculator_version": 81213.0, "project": "g2", "time": 515.11574792861938, "bsse_corrected": 0.0}


unique_id: 6df52f7fb765e776c4994be7853b6219
username: dulak
calculator: aims
data: null
calculator_parameters:
[cell repeats an earlier one in this file: 2964 characters]

key_value_pairs:
  {"name": "HCCl3", "basis": "aug-cc-pV5Z", "relativistic": 0.0, "relaxed": true, "calculator_version": 81213.0, "project": "g2", "time": 1993.773561000824, "bsse_corrected": 0.0}


unique_id: 19634e365bd576f54a62f9793fdcf7bd
username: dulak
calculator: aims
data: null
calculator_parameters:
[cell repeats an earlier one in this file: 2964 characters]

key_value_pairs:
  {"name": "H2CCl2", "basis": "aug-cc-pV5Z", "relativistic": 0.0, "relaxed": true, "calculator_version": 81213.0, "project": "g2", "time": 4100.462739944458, "bsse_corrected": 0.0}


unique_id: c65020ba3c3af7428b37feb5b82179e4
username: dulak
calculator: aims
data: null
calculator_parameters:
[cell repeats an earlier one in this file: 2964 characters]

key_value_pairs:
  {"name": "CH3NO2", "basis": "aug-cc-pV5Z", "relativistic": 0.0, "relaxed": false, "calculator_version": 81213.0, "project": "g2", "time": 752.13341093063354, "bsse_corrected": 0.0}


unique_id: 22e99fe94d74d4018e29d2704968a6da
username: dulak
calculator: aims
data: null
calculator_parameters:
[cell repeats an earlier one in this file: 2964 characters]

key_value_pairs:
  {"name": "C6H6", "basis": "aug-cc-pV5Z", "relativistic": 0.0, "relaxed": true, "calculator_version": 81213.0, "project": "g2", "time": 8063.3045649528503, "bsse_corrected": 0.0}


unique_id: 9e7e01b002a31c16b781c52bb338f25b
username: dulak
calculator: aims
data: null
calculator_parameters:
[cell repeats an earlier one in this file: 2964 characters]

key_value_pairs:
  {"name": "CH3ONO", "basis": "aug-cc-pV5Z", "relativistic": 0.0, "relaxed": false, "calculator_version": 81213.0, "project": "g2", "time": 861.02783417701721, "bsse_corrected": 0.0}


unique_id: e4b3525ca2a622205a48b3b6303fb003
username: dulak
calculator: aims
data: null
calculator_parameters:
[cell repeats an earlier one in this file: 2964 characters]

key_value_pairs:
  {"name": "bicyclobutane", "basis": "aug-cc-pV5Z", "relativistic": 0.0, "relaxed": true, "calculator_version": 81213.0, "project": "g2", "time": 18450.550039052963, "bsse_corrected": 0.0}


unique_id: 2f8d570fb728200977e825b9edba1197
username: dulak
calculator: aims
data: null
calculator_parameters:
[cell repeats an earlier one in this file: 2964 characters]

key_value_pairs:
  {"name": "CH3SiH3", "basis": "aug-cc-pV5Z", "relativistic": 0.0, "relaxed": false, "calculator_version": 81213.0, "project": "g2", "time": 730.39493799209595, "bsse_corrected": 0.0}


unique_id: 5471e1e858e6706718e1be1bb76504a9
username: dulak
calculator: aims
data: null
calculator_parameters:
[cell repeats an earlier one in this file: 2964 characters]

key_value_pairs:
  {"name": "HCOOH", "basis": "aug-cc-pV5Z", "relativistic": 0.0, "relaxed": false, "calculator_version": 81213.0, "project": "g2", "time": 372.39273285865784, "bsse_corrected": 0.0}


unique_id: 71bf5924a06c170329d56df64e561885
username: dulak
calculator: aims
data: null
calculator_parameters:
[cell repeats an earlier one in this file: 2964 characters]

key_value_pairs:
  {"name": "CH3CN", "basis": "aug-cc-pV5Z", "relativistic": 0.0, "relaxed": true, "calculator_version": 81213.0, "project": "g2", "time": 4595.0019190311432, "bsse_corrected": 0.0}


unique_id: 76df4bbc9594310799a17d933efd1b45
username: dulak
calculator: aims
data: null
calculator_parameters:
[cell repeats an earlier one in this file: 2964 characters]

key_value_pairs:
  {"name": "HCOOCH3", "basis": "aug-cc-pV5Z", "relativistic": 0.0, "relaxed": false, "calculator_version": 81213.0, "project": "g2", "time": 1043.7041110992432, "bsse_corrected": 0.0}


unique_id: 68f2b38d1761176f664e1f46fab49540
username: dulak
calculator: aims
data: null
calculator_parameters:
[cell repeats an earlier one in this file: 2964 characters]

key_value_pairs:
  {"name": "HCOOH", "basis": "aug-cc-pV5Z", "relativistic": 0.0, "relaxed": true, "calculator_version": 81213.0, "project": "g2", "time": 4181.5283441543579, "bsse_corrected": 0.0}


unique_id: 49cf066dba7a52c8434c7289fec503ce
username: dulak
calculator: aims
data: null
calculator_parameters:
[cell repeats an earlier one in this file: 2964 characters]

key_value_pairs:
  {"name": "CH3CONH2", "basis": "aug-cc-pV5Z", "relativistic": 0.0, "relaxed": false, "calculator_version": 81213.0, "project": "g2", "time": 1312.171403169632, "bsse_corrected": 0.0}


unique_id: 7de9ae1281dda7e02094f41e63da9960
username: dulak
calculator: aims
data: null
calculator_parameters:
[cell repeats an earlier one in this file: 2964 characters]

key_value_pairs:
  {"name": "H3CNH2", "basis": "aug-cc-pV5Z", "relativistic": 0.0, "relaxed": true, "calculator_version": 81213.0, "project": "g2", "time": 8538.2852981090546, "bsse_corrected": 0.0}


unique_id: 6d4035680b39b60dca345649b1e7852e
username: dulak
calculator: aims
data: null
calculator_parameters:
[cell repeats an earlier one in this file: 2964 characters]

key_value_pairs:
  {"name": "C5H8", "basis": "aug-cc-pV5Z", "relativistic": 0.0, "relaxed": true, "calculator_version": 81213.0, "project": "g2", "time": 20103.535633087158, "bsse_corrected": 0.0}


unique_id: 776f40be8b542cb9cb5ab1882361b28a
username: dulak
calculator: aims
data: null
calculator_parameters:
[cell repeats an earlier one in this file: 2964 characters]

key_value_pairs:
  {"name": "NCCN", "basis": "aug-cc-pV5Z", "relativistic": 0.0, "relaxed": false, "calculator_version": 81213.0, "project": "g2", "time": 285.80017113685608, "bsse_corrected": 0.0}


unique_id: a924a6d69b58d1892f2f9c10ef25d289
username: dulak
calculator: aims
data: null
calculator_parameters:
[cell repeats an earlier one in this file: 2964 characters]

key_value_pairs:
  {"name": "C3H8", "basis": "aug-cc-pV5Z", "relativistic": 0.0, "relaxed": true, "calculator_version": 81213.0, "project": "g2", "time": 27467.930999994278, "bsse_corrected": 0.0}


unique_id: 9b0631a62078002230e680731d1abc25
username: dulak
calculator: aims
data: null
calculator_parameters:
[cell repeats an earlier one in this file: 2964 characters]

key_value_pairs:
  {"name": "CH2NHCH2", "basis": "aug-cc-pV5Z", "relativistic": 0.0, "relaxed": false, "calculator_version": 81213.0, "project": "g2", "time": 840.76175403594971, "bsse_corrected": 0.0}


unique_id: e6da8b644de0efac2e6a0496ddb1c5bf
username: dulak
calculator: aims
data: null
calculator_parameters:
[cell repeats an earlier one in this file: 2964 characters]

key_value_pairs:
  {"name": "CH3NO2", "basis": "aug-cc-pV5Z", "relativistic": 0.0, "relaxed": true, "calculator_version": 81213.0, "project": "g2", "time": 8286.152538061142, "bsse_corrected": 0.0}


unique_id: 3ae4e17f8db733de9fa5ae1ddb75377e
username: dulak
calculator: aims
data: null
calculator_parameters:
[cell repeats an earlier one in this file: 2964 characters]

key_value_pairs:
  {"name": "C2H6NH", "basis": "aug-cc-pV5Z", "relativistic": 0.0, "relaxed": false, "calculator_version": 81213.0, "project": "g2", "time": 1204.5329270362854, "bsse_corrected": 0.0}


unique_id: 24c2a71318d59204941f12bf925402f2
username: dulak
calculator: aims
data: null
calculator_parameters:
[cell repeats an earlier one in this file: 2964 characters]

key_value_pairs:
  {"name": "NCCN", "basis": "aug-cc-pV5Z", "relativistic": 0.0, "relaxed": true, "calculator_version": 81213.0, "project": "g2", "time": 1324.066468000412, "bsse_corrected": 0.0}


unique_id: 9a348c494b0dc4d1b4925c8e297126ce
username: dulak
calculator: aims
data: null
calculator_parameters:
[cell repeats an earlier one in this file: 2964 characters]

key_value_pairs:
  {"name": "isobutene", "basis": "aug-cc-pV5Z", "relativistic": 0.0, "relaxed": true, "calculator_version": 81213.0, "project": "g2", "time": 24084.870559215546, "bsse_corrected": 0.0}


unique_id: 7eac0b8b32ce15fbfcf52c598ab6dd3a
username: dulak
calculator: aims
data: null
calculator_parameters:
[cell repeats an earlier one in this file: 2964 characters]

key_value_pairs:
  {"name": "H2CCO", "basis": "aug-cc-pV5Z", "relativistic": 0.0, "relaxed": false, "calculator_version": 81213.0, "project": "g2", "time": 357.07362198829651, "bsse_corrected": 0.0}


unique_id: 80cd04c94f8d521570732d26b6bcc5b5
username: dulak
calculator: aims
data: null
calculator_parameters:
[cell repeats an earlier one in this file: 2964 characters]

key_value_pairs:
  {"name": "CH2OCH2", "basis": "aug-cc-pV5Z", "relativistic": 0.0, "relaxed": false, "calculator_version": 81213.0, "project": "g2", "time": 742.71074819564819, "bsse_corrected": 0.0}


unique_id: a05f7c01d903cbb76945566d0cbb2f7f
username: dulak
calculator: aims
data: null
calculator_parameters:
[cell repeats an earlier one in this file: 2964 characters]

key_value_pairs:
  {"name": "CH3CH2NH2", "basis": "aug-cc-pV5Z", "relativistic": 0.0, "relaxed": false, "calculator_version": 81213.0, "project": "g2", "time": 1281.1705961227417, "bsse_corrected": 0.0}


unique_id: 50d892c8840365a003b5e7a1321304b2
username: dulak
calculator: aims
data: null
calculator_parameters:
[cell repeats an earlier one in this file: 2964 characters]

key_value_pairs:
  {"name": "CH3SiH3", "basis": "aug-cc-pV5Z", "relativistic": 0.0, "relaxed": true, "calculator_version": 81213.0, "project": "g2", "time": 8370.1596059799194, "bsse_corrected": 0.0}


unique_id: a75f3cb26d4662634c5370f876049a5e
username: dulak
calculator: aims
data: null
calculator_parameters:
[cell repeats an earlier one in this file: 2964 characters]

key_value_pairs:
  {"name": "CH3CHO", "basis": "aug-cc-pV5Z", "relativistic": 0.0, "relaxed": false, "calculator_version": 81213.0, "project": "g2", "time": 764.63517594337463, "bsse_corrected": 0.0}


unique_id: 892710662f34531b4c2fedf5a7cd1b77
username: dulak
calculator: aims
data: null
calculator_parameters:
[cell repeats an earlier one in this file: 2964 characters]

key_value_pairs:
  {"name": "H2CCO", "basis": "aug-cc-pV5Z", "relativistic": 0.0, "relaxed": true, "calculator_version": 81213.0, "project": "g2", "time": 2546.6380960941315, "bsse_corrected": 0.0}


unique_id: 57630ab36f5619c3d7e9b0a990579811
username: dulak
calculator: aims
data: null
calculator_parameters:
[cell repeats an earlier one in this file: 2964 characters]

key_value_pairs:
  {"name": "OCHCHO", "basis": "aug-cc-pV5Z", "relativistic": 0.0, "relaxed": false, "calculator_version": 81213.0, "project": "g2", "time": 583.6222939491272, "bsse_corrected": 0.0}


unique_id: 94cf33c61aa3eb7487c8a6b7959ff936
username: dulak
calculator: aims
data: null
calculator_parameters:
[cell repeats an earlier one in this file: 2964 characters]

key_value_pairs:
  {"name": "CH2OCH2", "basis": "aug-cc-pV5Z", "relativistic": 0.0, "relaxed": true, "calculator_version": 81213.0, "project": "g2", "time": 3742.3255231380463, "bsse_corrected": 0.0}


unique_id: cc31e3dad123bea7789db6043c614f24
username: dulak
calculator: aims
data: null
calculator_parameters:
[cell repeats an earlier one in this file: 2964 characters]

key_value_pairs:
  {"name": "CH3CH2OH", "basis": "aug-cc-pV5Z", "relativistic": 0.0, "relaxed": false, "calculator_version": 81213.0, "project": "g2", "time": 1060.229043006897, "bsse_corrected": 0.0}


unique_id: b3d497dd4a527e658515f9966be93c81
username: dulak
calculator: aims
data: null
calculator_parameters:
[cell repeats an earlier one in this file: 2964 characters]

key_value_pairs:
  {"name": "CH2NHCH2", "basis": "aug-cc-pV5Z", "relativistic": 0.0, "relaxed": true, "calculator_version": 81213.0, "project": "g2", "time": 8663.1378200054169, "bsse_corrected": 0.0}


unique_id: 2bab0e5473e97e92ae291a7235432d9e
username: dulak
calculator: aims
data: null
calculator_parameters:
[cell repeats an earlier one in this file: 2964 characters]

key_value_pairs:
  {"name": "CH3ONO", "basis": "aug-cc-pV5Z", "relativistic": 0.0, "relaxed": true, "calculator_version": 81213.0, "project": "g2", "time": 16038.98309803009, "bsse_corrected": 0.0}


unique_id: bc1493041b1817f0c2707648d5f9d858
username: dulak
calculator: aims
data: null
calculator_parameters:
[cell repeats an earlier one in this file: 2964 characters]

key_value_pairs:
  {"name": "OCHCHO", "basis": "aug-cc-pV5Z", "relativistic": 0.0, "relaxed": true, "calculator_version": 81213.0, "project": "g2", "time": 4726.5397169589996, "bsse_corrected": 0.0}


unique_id: c68bcc30a9d45a6bbe8247844066eeac
username: dulak
calculator: aims
data: null
calculator_parameters:
[cell repeats an earlier one in this file: 2964 characters]

key_value_pairs:
  {"name": "cyclobutane", "basis": "aug-cc-pV5Z", "relativistic": 0.0, "relaxed": true, "calculator_version": 81213.0, "project": "g2", "time": 33013.899970054626, "bsse_corrected": 0.0}


unique_id: da6536c6f095ff3abfc7184527b91379
username: dulak
calculator: aims
data: null
calculator_parameters:
[cell repeats an earlier one in this file: 2964 characters]

key_value_pairs:
  {"name": "CH2SCH2", "basis": "aug-cc-pV5Z", "relativistic": 0.0, "relaxed": false, "calculator_version": 81213.0, "project": "g2", "time": 779.45429801940918, "bsse_corrected": 0.0}


unique_id: 88a73c8419608bee0279be8f98a973fd
username: dulak
calculator: aims
data: null
calculator_parameters:
[cell repeats an earlier one in this file: 2964 characters]

key_value_pairs:
  {"name": "CH3OCH3", "basis": "aug-cc-pV5Z", "relativistic": 0.0, "relaxed": false, "calculator_version": 81213.0, "project": "g2", "time": 1058.1040890216827, "bsse_corrected": 0.0}


unique_id: a72e8e7d72664cacb527fd582f4b6869
username: dulak
calculator: aims
data: null
calculator_parameters:
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