B9CSD8 -OEChem-04022117553D 38 40 0 0 0 0 0 0 0999 V2000 7.2475 -0.0880 -0.1158 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.5904 -1.8420 -0.6008 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.4633 0.3585 2.0390 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.0463 -3.3088 -1.1560 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9199 -2.5581 -0.8320 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5095 -0.8125 0.6663 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7264 -1.5948 0.3287 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7703 -0.4300 0.3096 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2776 -0.5442 0.4512 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5465 2.1853 0.1861 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7792 1.7384 0.8969 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6025 -1.3663 0.9235 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3228 0.6118 -0.4354 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5996 2.9625 0.8532 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3409 1.8263 -1.1458 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0883 -1.6855 -0.1858 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9872 -1.2607 0.7922 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7074 0.7173 -0.5666 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8660 -0.8055 0.8953 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5396 -0.2188 0.0471 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4469 3.3807 0.1881 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1883 2.2443 -1.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2414 3.0216 -1.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2824 -2.5315 -0.5842 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0400 -0.7503 1.5019 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8101 0.4139 0.2017 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1989 2.5725 1.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5577 1.4370 0.1866 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1850 -2.1811 1.5091 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6869 1.3472 -0.9208 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7480 3.2510 1.8905 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0689 1.2197 -1.6781 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6234 -1.9970 1.2765 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1239 1.5341 -1.1506 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2911 3.9849 0.7075 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0271 1.9628 -2.8474 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6571 3.3453 -1.6612 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5402 -3.2270 -1.4944 H 0 0 0 0 0 0 0 0 0 0 0 0 1 20 1 0 0 0 0 2 9 1 0 0 0 0 2 16 1 0 0 0 0 3 11 1 0 0 0 0 3 19 1 0 0 0 0 4 24 2 0 0 0 0 5 16 1 0 0 0 0 5 24 1 0 0 0 0 5 38 1 0 0 0 0 6 16 2 0 0 0 0 6 19 1 0 0 0 0 7 19 2 0 0 0 0 7 24 1 0 0 0 0 8 9 1 0 0 0 0 8 12 2 0 0 0 0 8 13 1 0 0 0 0 9 25 1 0 0 0 0 9 26 1 0 0 0 0 10 11 1 0 0 0 0 10 14 2 0 0 0 0 10 15 1 0 0 0 0 11 27 1 0 0 0 0 11 28 1 0 0 0 0 12 17 1 0 0 0 0 12 29 1 0 0 0 0 13 18 2 0 0 0 0 13 30 1 0 0 0 0 14 21 1 0 0 0 0 14 31 1 0 0 0 0 15 22 2 0 0 0 0 15 32 1 0 0 0 0 17 20 2 0 0 0 0 17 33 1 0 0 0 0 18 20 1 0 0 0 0 18 34 1 0 0 0 0 21 23 2 0 0 0 0 21 35 1 0 0 0 0 22 23 1 0 0 0 0 22 36 1 0 0 0 0 23 37 1 0 0 0 0 M END $$$$