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HEADER Pyridoxine: Vitamin B6
COMPND c8h11no3
AUTHOR Created by Dave Woodcock at Okanagan University College
AUTHOR email:woodcock@okanagan.bc.ca
AUTHOR Date revised: Fri Sep 1 09:41:05 2000 GENERATED BY BABEL 1.6
HETATM 1 C 1 0.000 0.000 0.000 1.00 0.00
HETATM 2 C 1 1.399 0.000 0.000 1.00 0.00
HETATM 3 C 1 2.095 1.214 0.000 1.00 0.00
HETATM 4 C 1 1.381 2.418 0.018 1.00 0.00
HETATM 5 C 1 -0.018 2.390 0.005 1.00 0.00
HETATM 6 N 1 -0.688 1.189 -0.006 1.00 0.00
HETATM 7 C 1 -0.754 -1.311 0.010 1.00 0.00
HETATM 8 O 1 2.079 -1.180 0.011 1.00 0.00
HETATM 9 C 1 3.608 1.210 0.001 1.00 0.00
HETATM 10 O 1 4.077 1.576 1.303 1.00 0.00
HETATM 11 C 1 2.102 3.747 0.058 1.00 0.00
HETATM 12 O 1 1.197 4.767 0.493 1.00 0.00
HETATM 13 H 1 -0.583 3.322 0.008 1.00 0.00
HETATM 14 H 1 -0.438 -1.905 0.867 1.00 0.00
HETATM 15 H 1 -0.543 -1.858 -0.909 1.00 0.00
HETATM 16 H 1 -1.824 -1.114 0.078 1.00 0.00
HETATM 17 H 1 2.145 -1.522 -0.886 1.00 0.00
HETATM 18 H 1 3.977 1.922 -0.737 1.00 0.00
HETATM 19 H 1 3.973 0.214 -0.250 1.00 0.00
HETATM 20 H 1 5.040 1.579 1.315 1.00 0.00
HETATM 21 H 1 2.472 3.988 -0.939 1.00 0.00
HETATM 22 H 1 2.940 3.690 0.753 1.00 0.00
HETATM 23 H 1 1.650 5.617 0.520 1.00 0.00
CONECT 1 2 6 7
CONECT 1 2
CONECT 2 1 3 8
CONECT 3 2 4 9
CONECT 3 4
CONECT 4 3 5 11
CONECT 5 4 6 13
CONECT 5 6
CONECT 6 1 5
CONECT 7 1 14 15 16
CONECT 8 2 17
CONECT 9 3 10 18 19
CONECT 10 9 20
CONECT 11 4 12 21 22
CONECT 12 11 23
CONECT 13 5
CONECT 14 7
CONECT 15 7
CONECT 16 7
CONECT 17 8
CONECT 18 9
CONECT 19 9
CONECT 20 10
CONECT 21 11
CONECT 22 11
CONECT 23 12
MASTER 0 0 0 0 0 0 0 0 23 0 23 0
END
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