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test.pdb
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HETATM 1 O UNL 1 1.233 0.554 0.779 1.00 0.00 O
HETATM 2 O UNL 1 -0.695 -2.715 -0.750 1.00 0.00 O
HETATM 3 O UNL 1 0.796 -2.184 0.869 1.00 0.00 O
HETATM 4 O UNL 1 1.781 0.811 -1.482 1.00 0.00 O
HETATM 5 C UNL 1 -0.086 0.609 0.440 1.00 0.00 C
HETATM 6 C UNL 1 -0.793 -0.552 0.124 1.00 0.00 C
HETATM 7 C UNL 1 -0.729 1.846 0.413 1.00 0.00 C
HETATM 8 C UNL 1 -2.143 -0.474 -0.218 1.00 0.00 C
HETATM 9 C UNL 1 -2.079 1.924 0.071 1.00 0.00 C
HETATM 10 C UNL 1 -2.785 0.764 -0.245 1.00 0.00 C
HETATM 11 C UNL 1 -0.141 -1.854 0.148 1.00 0.00 C
HETATM 12 C UNL 1 2.109 0.672 -0.311 1.00 0.00 C
HETATM 13 C UNL 1 3.531 0.600 0.164 1.00 0.00 C
HETATM 14 H UNL 1 -0.185 2.755 0.659 1.00 0.00 H
HETATM 15 H UNL 1 -2.725 -1.361 -0.456 1.00 0.00 H
HETATM 16 H UNL 1 -2.580 2.887 0.051 1.00 0.00 H
HETATM 17 H UNL 1 -3.837 0.824 -0.509 1.00 0.00 H
HETATM 18 H UNL 1 3.729 1.418 0.859 1.00 0.00 H
HETATM 19 H UNL 1 4.205 0.697 -0.692 1.00 0.00 H
HETATM 20 H UNL 1 3.711 -0.366 0.643 1.00 0.00 H
HETATM 21 H UNL 1 -0.256 -3.592 -0.734 1.00 0.00 H
CONECT 1 5 12
CONECT 2 11 21
CONECT 3 11
CONECT 4 12
CONECT 5 1 6 7
CONECT 6 5 8 11
CONECT 7 5 9 14
CONECT 8 6 10 15
CONECT 9 7 10 16
CONECT 10 8 9 17
CONECT 11 2 3 6
CONECT 12 1 4 13
CONECT 13 12 18 19 20
CONECT 14 7
CONECT 15 8
CONECT 16 9
CONECT 17 10
CONECT 18 13
CONECT 19 13
CONECT 20 13
CONECT 21 2
END