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- COMPND UNNAMED
- AUTHOR GENERATED BY OPEN BABEL 2.3.0
- HETATM 1 C LIG 1 -2.857 2.918 -0.552 1.00 0.00 C
- HETATM 2 C LIG 1 -1.322 3.005 -0.530 1.00 0.00 C
- HETATM 3 H LIG 1 -3.180 2.184 -1.301 1.00 0.00 H
- HETATM 4 H LIG 1 -3.283 3.884 -0.849 1.00 0.00 H
- HETATM 5 C LIG 1 -3.383 2.517 0.836 1.00 0.00 C
- HETATM 6 H LIG 1 -0.954 3.289 -1.522 1.00 0.00 H
- HETATM 7 C LIG 1 -0.742 1.637 -0.133 1.00 0.00 C
- HETATM 8 C LIG 1 -0.890 4.058 0.505 1.00 0.00 C
- HETATM 9 H LIG 1 -1.027 0.881 -0.875 1.00 0.00 H
- HETATM 10 C LIG 1 -1.257 1.230 1.257 1.00 0.00 C
- HETATM 11 H LIG 1 0.289 0.539 0.525 1.00 0.00 H
- HETATM 12 C LIG 1 -2.793 1.151 1.226 1.00 0.00 C
- HETATM 13 H LIG 1 -4.476 2.454 0.814 1.00 0.00 H
- HETATM 14 C LIG 1 -2.945 3.571 1.868 1.00 0.00 C
- HETATM 15 C LIG 1 -0.824 2.287 2.288 1.00 0.00 C
- HETATM 16 C LIG 1 -1.401 3.674 1.914 1.00 0.00 C
- HETATM 17 H LIG 1 -3.340 3.305 2.858 1.00 0.00 H
- HETATM 18 H LIG 1 -3.386 4.543 1.611 1.00 0.00 H
- HETATM 19 H LIG 1 -0.842 0.253 1.533 1.00 0.00 H
- HETATM 20 H LIG 1 -3.114 0.386 0.509 1.00 0.00 H
- HETATM 21 H LIG 1 -3.172 0.846 2.209 1.00 0.00 H
- HETATM 22 H LIG 1 -1.277 5.044 0.213 1.00 0.00 H
- HETATM 23 H LIG 1 0.206 4.146 0.506 1.00 0.00 H
- HETATM 24 H LIG 1 0.272 2.329 2.335 1.00 0.00 H
- HETATM 25 H LIG 1 -1.165 1.988 3.288 1.00 0.00 H
- CONECT 1 2 3 4 5
- CONECT 1
- CONECT 2 1 6 7 8
- CONECT 2
- CONECT 3 1
- CONECT 4 1
- CONECT 5 1 12 13 14
- CONECT 5
- CONECT 6 2
- CONECT 7 2 9 10 11
- CONECT 7
- CONECT 8 2 16 22 23
- CONECT 8
- CONECT 9 7
- CONECT 10 7 15 12 19
- CONECT 10
- CONECT 11 7
- CONECT 12 5 10 20 21
- CONECT 12
- CONECT 13 5
- CONECT 14 5 16 17 18
- CONECT 14
- CONECT 15 10 16 24 25
- CONECT 15
- CONECT 16 8 14 15
- CONECT 17 14
- CONECT 18 14
- CONECT 19 10
- CONECT 20 12
- CONECT 21 12
- CONECT 22 8
- CONECT 23 8
- CONECT 24 15
- CONECT 25 15
- MASTER 0 0 0 0 0 0 0 0 25 0 25 0
- END
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