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# Created by UNITY Export Utility
# User: stiefni2
# Creation Date: Mon Aug 11 09:33:58 2008
@<TRIPOS>MOLECULE
chargedMol
18 18 1
SMALL
No_CHARGES
@<TRIPOS>ATOM
1 C 2.2501 0.5000 0.0000 C.ar 1 <1>
2 H 2.7694 0.8005 0.0000 H 1 <1>
3 C 1.3801 1.0000 0.0000 C.ar 1 <1>
4 H 1.3786 1.6000 0.0000 H 1 <1>
5 C 0.5201 0.5000 0.0000 C.ar 1 <1>
6 H 0.0000 0.7992 0.0000 H 1 <1>
7 C 0.5201 -0.5000 0.0000 C.ar 1 <1>
8 H 0.0000 -0.7992 0.0000 H 1 <1>
9 C 1.3801 -1.0000 0.0000 C.ar 1 <1>
10 H 1.3786 -1.6000 0.0000 H 1 <1>
11 C 2.2501 -0.5000 0.0000 C.ar 1 <1>
12 C 3.1156 -1.0009 0.0000 C.3 1 <1>
13 H 3.5008 -1.4609 0.0000 H 1 <1>
14 H 2.7295 -1.4601 0.0000 H 1 <1>
15 C 3.9851 -0.5000 0.0000 C.3 1 <1>
16 H 3.6000 -0.0399 0.0000 H 1 <1>
17 H 4.3716 -0.0410 0.0000 H 1 <1>
18 N 4.8456 -0.9991 0.0000 N.4 1 <1>
@<TRIPOS>BOND
1 1 11 ar
2 1 3 ar
3 3 5 ar
4 5 7 ar
5 7 9 ar
6 9 11 ar
7 11 12 1
8 12 15 1
9 15 18 1
10 1 2 1
11 3 4 1
12 5 6 1
13 7 8 1
14 9 10 1
15 12 13 1
16 12 14 1
17 15 16 1
18 15 17 1
@<TRIPOS>SUBSTRUCTURE
1 **** 1 TEMP 0 **** **** 0 ROOT
@<TRIPOS>UNITY_ATOM_ATTR
18 1
AtomExpr +1
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