B7KIW9 -OEChem-04022107542D 46 49 0 0 0 0 0 0 0999 V2000 7.1846 -1.9772 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0564 -0.4806 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.5865 -2.5048 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.5865 0.4953 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.7205 -1.0048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7205 -2.0048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9204 -0.9839 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8265 -0.4701 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5865 -0.5047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8265 -2.5394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9204 -2.0256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4525 -2.0048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4525 -1.0048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3243 -0.4739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5961 0.5327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1884 -0.9773 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.0361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3282 0.5261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4564 -0.9706 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.0294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5923 -0.4672 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3185 -2.5048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7359 2.0361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8641 0.5394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8718 2.5394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.0428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0038 2.0428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8337 0.1499 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8337 -3.1594 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3847 -2.3376 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9894 -0.6947 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0587 0.1394 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8663 0.8340 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4540 -1.5906 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4665 1.6494 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0542 -0.7752 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0085 -3.0417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8555 -2.8148 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6285 -1.9678 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1234 0.8053 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0495 0.8053 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2740 2.3440 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8617 -0.0806 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8742 3.1594 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4619 0.7348 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4681 2.3548 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 16 2 0 0 0 0 2 7 1 0 0 0 0 2 16 1 0 0 0 0 2 32 1 0 0 0 0 3 6 2 0 0 0 0 3 12 1 0 0 0 0 4 9 1 0 0 0 0 4 40 1 0 0 0 0 4 41 1 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 5 9 2 0 0 0 0 6 10 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 28 1 0 0 0 0 9 13 1 0 0 0 0 10 11 2 0 0 0 0 10 29 1 0 0 0 0 11 30 1 0 0 0 0 12 13 2 0 0 0 0 12 22 1 0 0 0 0 13 31 1 0 0 0 0 14 16 1 0 0 0 0 14 18 2 0 0 0 0 14 19 1 0 0 0 0 15 17 1 0 0 0 0 15 20 2 0 0 0 0 15 21 1 0 0 0 0 17 23 2 0 0 0 0 17 24 1 0 0 0 0 18 20 1 0 0 0 0 18 33 1 0 0 0 0 19 21 2 0 0 0 0 19 34 1 0 0 0 0 20 35 1 0 0 0 0 21 36 1 0 0 0 0 22 37 1 0 0 0 0 22 38 1 0 0 0 0 22 39 1 0 0 0 0 23 25 1 0 0 0 0 23 42 1 0 0 0 0 24 26 2 0 0 0 0 24 43 1 0 0 0 0 25 27 2 0 0 0 0 25 44 1 0 0 0 0 26 27 1 0 0 0 0 26 45 1 0 0 0 0 27 46 1 0 0 0 0 M END $$$$