PM7 Accuracy
Date:Mon Feb 11 04:20:05 2019
c5h5znmer
3714 Cyclopentadienylmethylzinc (Geo)
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REF: A. Haaland, S. Samdal, R. Seip, J. Organomet. Chem., 153, 187 (1978).
NOINTER NOXYZ PM7
Cyclopentadienylmethylzinc
<C-C> <C-Zn> <> <Zn-C(H3)> GR=HSS1978
C 0.00000000 +0 0.0000000 +0 0.0000000 +0 0 0 0
C 1.43800000 +1 0.0000000 +0 0.0000000 +0 1 0 0
Zn 2.28000000 +1 107.5981022 +1 0.0000000 +0 1 2 0
C 1.90300000 +1 157.0036600 +1 88.5220146 +1 3 1 2
C 1.40730294 +1 108.3867113 +1 71.1933998 +1 2 1 3
C 1.46238763 +1 106.6879718 +1 -71.1641710 +1 1 2 3
C 1.42397604 +1 106.8463144 +1 -0.4237839 +1 6 1 2
H 1.07079267 +1 124.9579419 +1 124.8811524 +1 1 2 3
H 1.06601933 +1 125.0809196 +1 -109.9702434 +1 2 1 3
H 1.06883682 +1 125.4148575 +1 179.8858556 +1 5 2 1
H 1.07677167 +1 124.9755925 +1 -159.1713946 +1 6 1 2
H 1.06883991 +1 125.0839069 +1 -177.8094470 +1 7 6 1
H 1.08603289 +1 109.3678243 +1 -30.2931461 +1 4 3 1
H 1.08495586 +1 110.1613256 +1 89.8737125 +1 4 3 1
H 1.08598929 +1 109.4660494 +1 -149.8994079 +1 4 3 1