BXJ9N3 -OEChem-04022110203D 51 52 0 1 0 0 0 0 0999 V2000 1.4537 2.3712 2.1468 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9956 -0.8576 1.3990 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0556 0.1586 -1.0876 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8476 3.1799 -2.0189 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7026 0.0356 2.6492 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7094 -1.8340 -2.1973 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1482 2.4820 -0.5887 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6711 1.4007 0.0273 C 0 0 2 0 0 0 0 0 0 0 0 0 0.6455 1.3381 1.5800 C 0 0 2 0 0 0 0 0 0 0 0 0 2.1046 1.4408 -0.5193 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7467 1.3665 2.2307 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7610 0.0924 -0.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7392 -2.0666 1.1104 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.7777 -1.8039 -0.0040 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.1376 2.2766 -1.5638 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1021 3.8613 -0.1709 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5947 0.1157 2.1295 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3353 0.8712 -2.0925 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1269 -1.1966 -1.2399 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7028 -3.1325 0.7629 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5803 -3.0475 -0.3806 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4787 -0.2659 0.7031 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6527 -0.8017 -1.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0884 -1.5182 0.7790 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2623 -2.0539 -1.4272 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9802 -2.4122 -0.2861 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2376 0.4563 -0.2992 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1237 0.4018 1.8884 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7192 2.1948 -0.0128 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0933 1.7524 -1.5732 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3371 2.1963 1.8295 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6246 1.5614 3.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2555 -2.3879 2.0243 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5048 -1.0641 0.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2396 3.9963 0.8577 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4222 4.5830 -0.8026 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1734 4.0694 -0.2332 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4961 2.2220 3.1066 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9424 0.9175 -3.0033 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3758 0.4034 -2.3332 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1216 -2.8527 -0.1219 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1616 -4.1100 0.5925 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0183 -3.2351 1.5819 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9568 -3.8148 -0.8505 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3670 -2.7911 -1.0991 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0587 -3.4844 0.5018 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5815 0.4231 1.5369 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0947 -0.5361 -2.3969 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6492 -1.7963 1.6666 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1772 -2.7504 -2.2561 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4549 -3.3873 -0.2272 H 0 0 0 0 0 0 0 0 0 0 0 0 1 9 1 0 0 0 0 1 38 1 0 0 0 0 2 13 1 0 0 0 0 2 17 1 0 0 0 0 3 18 1 0 0 0 0 3 19 1 0 0 0 0 4 15 2 0 0 0 0 5 17 2 0 0 0 0 6 19 2 0 0 0 0 7 8 1 0 0 0 0 7 15 1 0 0 0 0 7 16 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 27 1 0 0 0 0 9 11 1 0 0 0 0 9 28 1 0 0 0 0 10 12 1 0 0 0 0 10 29 1 0 0 0 0 10 30 1 0 0 0 0 11 17 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 12 22 2 0 0 0 0 12 23 1 0 0 0 0 13 14 1 0 0 0 0 13 20 1 0 0 0 0 13 33 1 0 0 0 0 14 19 1 0 0 0 0 14 21 1 0 0 0 0 14 34 1 0 0 0 0 15 18 1 0 0 0 0 16 35 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 20 43 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 21 46 1 0 0 0 0 22 24 1 0 0 0 0 22 47 1 0 0 0 0 23 25 2 0 0 0 0 23 48 1 0 0 0 0 24 26 2 0 0 0 0 24 49 1 0 0 0 0 25 26 1 0 0 0 0 25 50 1 0 0 0 0 26 51 1 0 0 0 0 M END $$$$