B5T2HG -OEChem-04012117222D 79 83 0 1 0 0 0 0 0999 V2000 11.2989 0.6065 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.3867 0.5495 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6079 3.1756 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5388 2.5033 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5000 0.6938 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0000 -1.9043 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 -2.7703 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5388 0.3277 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.5878 -0.9813 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2788 1.5878 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5000 -1.0383 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.8867 1.4155 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.2989 2.2245 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.3479 1.9155 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.3479 0.9155 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.8867 1.4155 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3867 0.5495 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5878 0.6368 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5388 -0.6723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3867 -0.4505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3867 1.5495 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3867 0.5495 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0000 -0.1723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5207 -0.9505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2527 2.0495 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8867 -0.3165 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2527 -0.9505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5207 2.0495 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8867 1.4155 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0000 -0.1723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5207 -1.9505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2527 3.0495 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8867 -0.3165 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2527 -1.9505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5207 3.0495 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8867 1.4155 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3867 -2.4505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3867 3.5495 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3867 0.5495 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5000 -1.0383 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0000 -1.9043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 -2.7703 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.6364 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1682 0.8631 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8605 2.6630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7954 1.6341 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7954 1.1970 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4693 1.6276 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7790 2.0261 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1931 3.6364 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6036 3.1199 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0404 -1.0367 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6723 1.7167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6936 2.0486 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9837 -0.6405 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.7897 1.7395 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5767 -0.8535 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.7897 -0.6405 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9837 1.7395 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5767 1.9525 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9837 -2.2605 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.7897 3.3595 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.1967 -0.8535 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.7897 -2.2605 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9837 3.3595 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.1967 1.9525 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3867 -3.0705 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3867 4.1695 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.0067 0.5495 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8100 -1.5752 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6077 -0.4277 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9174 -0.8262 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1077 -1.2937 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4174 -1.6922 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3923 -3.3809 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0826 -2.9824 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -3.3264 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 -4.1733 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -3.9464 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 12 1 0 0 0 0 1 15 1 0 0 0 0 2 16 1 0 0 0 0 2 17 1 0 0 0 0 13 3 1 6 0 0 0 3 50 1 0 0 0 0 14 4 1 6 0 0 0 4 51 1 0 0 0 0 5 30 2 0 0 0 0 6 40 1 0 0 0 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