B1JLM9 -OEChem-04022115193D 35 40 0 0 0 0 0 0 0999 V2000 -2.2496 -3.1697 0.0011 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4576 -0.2356 -0.0001 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3191 -0.1394 -0.0003 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0472 -3.5607 0.0004 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6776 2.0058 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3553 2.1213 0.0011 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7071 -1.4158 -0.0001 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6447 -1.3660 -0.0002 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8329 1.0056 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5970 1.0559 0.0001 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2590 -2.7915 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8167 0.0152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6550 0.2296 -0.0006 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0986 -2.7735 0.0004 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9176 1.4109 -0.0001 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6369 1.6314 0.0007 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9477 -0.8106 0.0001 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8635 -0.4789 -0.0018 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1881 2.0141 -0.0003 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8470 2.3491 0.0013 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2022 -0.1913 -0.0001 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0575 0.2526 -0.0014 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3229 1.1972 -0.0004 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0523 1.6443 0.0002 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8279 -3.0289 0.9022 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8276 -3.0292 -0.9023 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0251 -4.5756 0.0009 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8733 -1.8915 0.0002 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9074 -1.5583 -0.0032 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2910 3.0948 -0.0005 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8482 3.4349 0.0024 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0990 -0.8060 -0.0001 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0062 -0.2786 -0.0024 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3102 1.6516 -0.0006 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9931 2.1879 0.0005 H 0 0 0 0 0 0 0 0 0 0 0 0 1 14 2 0 0 0 0 2 7 1 0 0 0 0 2 9 1 0 0 0 0 2 12 1 0 0 0 0 3 8 1 0 0 0 0 3 10 1 0 0 0 0 3 13 1 0 0 0 0 4 11 1 0 0 0 0 4 14 1 0 0 0 0 4 27 1 0 0 0 0 5 9 2 0 0 0 0 5 15 1 0 0 0 0 6 10 2 0 0 0 0 6 16 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 14 1 0 0 0 0 9 10 1 0 0 0 0 11 25 1 0 0 0 0 11 26 1 0 0 0 0 12 15 1 0 0 0 0 12 17 2 0 0 0 0 13 16 1 0 0 0 0 13 18 2 0 0 0 0 15 19 2 0 0 0 0 16 20 2 0 0 0 0 17 21 1 0 0 0 0 17 28 1 0 0 0 0 18 22 1 0 0 0 0 18 29 1 0 0 0 0 19 23 1 0 0 0 0 19 30 1 0 0 0 0 20 24 1 0 0 0 0 20 31 1 0 0 0 0 21 23 2 0 0 0 0 21 32 1 0 0 0 0 22 24 2 0 0 0 0 22 33 1 0 0 0 0 23 34 1 0 0 0 0 24 35 1 0 0 0 0 M END $$$$