BQSB36 -OEChem-04012115053D 59 62 0 0 0 0 0 0 0999 V2000 -4.5571 0.6973 0.0115 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0477 -0.1452 -0.0883 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1938 0.3415 -0.0893 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2625 1.6809 -0.0030 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0039 2.1988 0.0857 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9197 -0.1453 -0.1042 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6045 -1.5861 -0.1958 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0977 0.9521 -0.0219 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1876 -2.1909 1.1581 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3678 -0.4097 -0.1527 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9790 2.0483 0.0378 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6114 0.9406 -0.0036 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8285 -3.6643 1.0496 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3615 2.4945 0.0983 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8068 3.8149 0.1597 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2667 -0.2119 -1.2006 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6417 -1.3598 0.8312 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2835 1.4491 0.0486 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6510 1.7240 0.0603 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1743 4.0899 0.1712 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0965 3.0445 0.1215 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4396 -0.9641 -1.2648 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8147 -2.1121 0.7672 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8420 4.9546 0.2138 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7137 -1.9141 -0.2808 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0279 -0.6214 -0.0497 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1486 -1.6012 -0.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7093 -2.1302 1.0216 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6359 -1.9887 -1.3891 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7574 -3.0467 0.9359 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6839 -2.9051 -1.4748 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2447 -3.4341 -0.3124 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7905 -1.7310 -0.9177 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4355 -2.1656 -0.6129 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9788 -2.0751 1.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3213 -1.6535 1.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7574 3.1034 0.1092 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9966 -3.8139 0.3542 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6834 -4.2491 0.6954 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5296 -4.0558 2.0269 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6217 3.0020 0.1367 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0671 0.5211 -1.9786 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9877 -1.5000 1.6839 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9510 0.4299 0.0168 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5389 5.1126 0.2187 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1605 3.2644 0.1308 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1395 -0.8105 -2.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0337 -2.8437 1.5394 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3573 5.9208 0.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2075 4.9656 -0.6786 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2151 4.8868 1.1092 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6282 -2.4980 -0.3294 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4404 -0.8483 0.8503 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3942 -0.7507 -0.9376 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3405 -1.8348 2.0003 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2098 -1.5822 -2.3025 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1945 -3.4582 1.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0639 -3.2063 -2.4467 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0610 -4.1475 -0.3792 H 0 0 0 0 0 0 0 0 0 0 0 0 1 19 1 0 0 0 0 1 26 1 0 0 0 0 2 12 2 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 3 10 1 0 0 0 0 4 11 2 0 0 0 0 5 12 1 0 0 0 0 5 14 1 0 0 0 0 5 41 1 0 0 0 0 6 7 1 0 0 0 0 6 8 2 0 0 0 0 7 9 1 0 0 0 0 7 33 1 0 0 0 0 7 34 1 0 0 0 0 8 11 1 0 0 0 0 8 12 1 0 0 0 0 9 13 1 0 0 0 0 9 35 1 0 0 0 0 9 36 1 0 0 0 0 10 16 2 0 0 0 0 10 17 1 0 0 0 0 11 37 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 14 15 2 0 0 0 0 14 18 1 0 0 0 0 15 20 1 0 0 0 0 15 24 1 0 0 0 0 16 22 1 0 0 0 0 16 42 1 0 0 0 0 17 23 2 0 0 0 0 17 43 1 0 0 0 0 18 19 2 0 0 0 0 18 44 1 0 0 0 0 19 21 1 0 0 0 0 20 21 2 0 0 0 0 20 45 1 0 0 0 0 21 46 1 0 0 0 0 22 25 2 0 0 0 0 22 47 1 0 0 0 0 23 25 1 0 0 0 0 23 48 1 0 0 0 0 24 49 1 0 0 0 0 24 50 1 0 0 0 0 24 51 1 0 0 0 0 25 52 1 0 0 0 0 26 27 1 0 0 0 0 26 53 1 0 0 0 0 26 54 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 28 30 1 0 0 0 0 28 55 1 0 0 0 0 29 31 2 0 0 0 0 29 56 1 0 0 0 0 30 32 2 0 0 0 0 30 57 1 0 0 0 0 31 32 1 0 0 0 0 31 58 1 0 0 0 0 32 59 1 0 0 0 0 M END $$$$