B7NXH8 -OEChem-04042102493D 38 40 0 0 0 0 0 0 0999 V2000 1.0770 -1.4389 -1.3936 S 0 0 0 0 0 0 0 0 0 0 0 0 2.0491 -1.6778 -2.4440 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1923 -2.5089 -0.9742 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1646 -0.0375 -1.7922 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0417 -1.3325 -0.7213 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6328 0.5764 -0.7686 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2835 1.8491 -0.3104 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7327 -0.1070 -0.2571 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8983 2.5747 -0.8676 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4968 0.5228 0.7476 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0404 2.4634 0.6795 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1455 1.8029 1.2086 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9806 -0.8969 0.0287 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4938 3.6660 -1.8536 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6040 -0.1646 1.2628 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4399 -1.0638 1.3036 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2315 -0.2995 -0.1258 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9248 -1.4276 0.7865 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1182 -1.9622 -0.1976 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1502 -0.6332 2.4243 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9418 0.1310 0.9948 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4011 -0.0357 2.2699 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4493 3.0365 -0.0372 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6275 1.9121 -1.3414 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5442 0.5851 -2.5155 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7833 3.4522 1.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7312 2.2925 1.9835 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0444 3.2433 -2.7088 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3830 4.1804 -2.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1535 4.4140 -1.3838 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2226 0.2807 2.0385 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4689 -1.5281 1.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6677 -0.1517 -1.1095 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7771 -1.9733 1.1736 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3196 -2.9461 -0.6083 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7291 -0.7628 3.4169 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9148 0.5984 0.8747 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9538 0.3003 3.1423 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 4 1 0 0 0 0 1 13 1 0 0 0 0 4 6 1 0 0 0 0 4 25 1 0 0 0 0 5 8 1 0 0 0 0 5 19 2 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 7 9 1 0 0 0 0 7 11 1 0 0 0 0 8 10 2 0 0 0 0 9 14 1 0 0 0 0 9 23 1 0 0 0 0 9 24 1 0 0 0 0 10 12 1 0 0 0 0 10 15 1 0 0 0 0 11 12 2 0 0 0 0 11 26 1 0 0 0 0 12 27 1 0 0 0 0 13 16 2 0 0 0 0 13 17 1 0 0 0 0 14 28 1 0 0 0 0 14 29 1 0 0 0 0 14 30 1 0 0 0 0 15 18 2 0 0 0 0 15 31 1 0 0 0 0 16 20 1 0 0 0 0 16 32 1 0 0 0 0 17 21 2 0 0 0 0 17 33 1 0 0 0 0 18 19 1 0 0 0 0 18 34 1 0 0 0 0 19 35 1 0 0 0 0 20 22 2 0 0 0 0 20 36 1 0 0 0 0 21 22 1 0 0 0 0 21 37 1 0 0 0 0 22 38 1 0 0 0 0 M END $$$$