PM7 Accuracy
Date:Mon Feb 11 04:20:05 2019
2-methylpiperidine
511 2-Methylpiperidine
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ΔHf: -20.2 kcal/mol, REF: NIST Chemistry WebBook, NIST Standard Reference Database, No. 69; W. G. Mallard, P. J. Linstrom, Eds., National Institute of Standards and Technology, Gaithersberg, http://webbook.nist.gov/chemistry.
PM7
2-Methylpiperidine
H=-20.19 HR=NIST
C 0.00000000 +0 0.0000000 +0 0.0000000 +0 0 0 0
C 1.53596385 +1 0.0000000 +0 0.0000000 +0 1 0 0
C 1.54507932 +1 110.3658165 +1 0.0000000 +0 2 1 0
C 1.53306006 +1 109.9591250 +1 -177.8547396 +1 3 2 1
C 1.53357315 +1 109.4719631 +1 57.3131101 +1 4 3 2
C 1.54064050 +1 110.3082205 +1 -56.1844135 +1 5 4 3
N 1.48042102 +1 109.6202437 +1 57.4506823 +1 6 5 4
H 1.09840275 +1 110.6352476 +1 65.5352197 +1 1 2 3
H 1.09414298 +1 111.7064025 +1 119.5279296 +1 1 2 8
H 1.09387331 +1 111.2089385 +1 120.6253930 +1 1 2 9
H 1.12040336 +1 109.4643473 +1 119.6636389 +1 2 1 3
H 1.10227570 +1 110.1198263 +1 -122.4074379 +1 3 2 4
H 1.10707962 +1 109.2832507 +1 -116.9109367 +1 3 2 12
H 1.10504195 +1 110.3738121 +1 -121.6599034 +1 4 3 5
H 1.10479543 +1 110.2531412 +1 -116.9169722 +1 4 3 14
H 1.10276158 +1 110.8973016 +1 -122.2267291 +1 5 4 6
H 1.10785442 +1 109.6123526 +1 -117.5346513 +1 5 4 16
H 1.11066035 +1 109.8023121 +1 -124.3510045 +1 6 5 7
H 1.11159442 +1 109.7416437 +1 -117.7239003 +1 6 5 18
H 1.01738871 +1 110.9491357 +1 174.9790036 +1 7 6 5