BL4GQ6 -OEChem-04022112543D 40 42 0 0 0 0 0 0 0999 V2000 4.5194 -0.6701 -0.0007 S 0 0 0 0 0 0 0 0 0 0 0 0 5.0170 -1.2053 1.2594 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9933 -1.2268 -1.2597 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0721 -3.5761 0.0021 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4615 -0.9467 0.0008 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0115 -0.8804 0.0008 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2463 0.2064 0.0001 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7752 -0.7512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6555 1.5270 -0.0005 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0676 -2.2029 0.0014 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6849 -0.8491 -1.2074 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6855 -0.8470 1.2086 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6375 0.1031 0.0001 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0782 -0.7845 -1.2079 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0788 -0.7823 1.2082 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4586 -2.3062 0.0013 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2436 -1.1531 0.0007 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3708 2.1640 1.2072 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3704 2.1630 -1.2086 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8813 1.0713 -0.0023 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8011 3.4374 1.2069 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8007 3.4362 -1.2091 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5161 4.0734 -0.0013 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4608 -3.1068 0.0019 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1568 -0.8730 -2.1578 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1579 -0.8693 2.1593 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2663 0.9905 -0.0004 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5993 -0.7537 -2.1606 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6012 -0.7504 2.1601 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3285 -1.2204 0.0007 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5867 1.6827 2.1582 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5859 1.6808 -2.1593 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9666 1.1919 -0.0073 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4527 1.5220 -0.8994 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4605 1.5226 0.8982 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5792 3.9333 2.1473 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5785 3.9313 -2.1498 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0723 5.0646 -0.0018 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0807 -3.6510 0.0018 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5042 -4.4128 0.0024 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 3 2 0 0 0 0 1 8 1 0 0 0 0 1 20 1 0 0 0 0 4 16 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 7 2 0 0 0 0 5 10 1 0 0 0 0 6 11 2 0 0 0 0 6 12 1 0 0 0 0 7 9 1 0 0 0 0 7 13 1 0 0 0 0 8 14 2 0 0 0 0 8 15 1 0 0 0 0 9 18 2 0 0 0 0 9 19 1 0 0 0 0 10 16 2 0 0 0 0 10 24 1 0 0 0 0 11 14 1 0 0 0 0 11 25 1 0 0 0 0 12 15 2 0 0 0 0 12 26 1 0 0 0 0 13 17 2 0 0 0 0 13 27 1 0 0 0 0 14 28 1 0 0 0 0 15 29 1 0 0 0 0 16 17 1 0 0 0 0 17 30 1 0 0 0 0 18 21 1 0 0 0 0 18 31 1 0 0 0 0 19 22 2 0 0 0 0 19 32 1 0 0 0 0 20 33 1 0 0 0 0 20 34 1 0 0 0 0 20 35 1 0 0 0 0 21 23 2 0 0 0 0 21 36 1 0 0 0 0 22 23 1 0 0 0 0 22 37 1 0 0 0 0 23 38 1 0 0 0 0 M END $$$$