PM7 Accuracy
Date:Mon Feb 11 04:20:05 2019
1-norbornylcyanide
532 1-Norbornylcyanide
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ΔHf: 18.0 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
1-Norbornylcyanide
H=17.98 HR=NIST
C 0.00000000 +0 0.0000000 +0 0.0000000 +0 0 0 0
C 1.55209067 +1 0.0000000 +0 0.0000000 +0 1 0 0
C 1.55308263 +1 103.6773859 +1 0.0000000 +0 2 1 0
C 1.55794775 +1 102.9838345 +1 0.0852298 +1 3 2 1
C 1.55735208 +1 107.9891111 +1 -71.1835332 +1 4 3 2
C 1.55173419 +1 107.9131103 +1 70.7743710 +1 1 2 3
C 1.55303980 +1 101.6484944 +1 -106.4699130 +1 1 2 6
C 1.43609741 +1 114.1174346 +1 -128.1776697 +1 4 3 5
N 1.15666024 +1 145.5765355 +1 179.7671539 +1 8 3 4
H 1.09294123 +1 114.1274633 +1 -125.3860044 +1 1 2 7
H 1.09964889 +1 111.1583482 +1 119.7965618 +1 2 1 3
H 1.09820907 +1 111.9490380 +1 119.2811752 +1 2 1 11
H 1.10001457 +1 111.6412558 +1 119.5347825 +1 3 2 4
H 1.09832952 +1 112.2606071 +1 120.0130153 +1 3 2 13
H 1.10006045 +1 111.3732767 +1 -169.1287816 +1 5 4 3
H 1.09842329 +1 111.8696316 +1 119.4991051 +1 5 4 15
H 1.09822362 +1 111.9653060 +1 50.0793951 +1 6 1 2
H 1.09964913 +1 111.1589890 +1 119.2876696 +1 6 1 17
H 1.09515392 +1 113.9739185 +1 -62.1615952 +1 7 1 2
H 1.09509959 +1 113.9797680 +1 -124.2634550 +1 7 1 19