B1JN3L -OEChem-04042104353D 39 41 0 0 0 0 0 0 0999 V2000 9.1326 0.0724 -0.4208 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -3.5804 0.9765 0.2572 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.9029 -0.5406 -1.1292 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6248 -0.7278 -0.1632 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2383 -1.1461 2.2546 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6267 1.5602 0.2197 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7827 -0.2311 -0.6500 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.1011 1.6133 0.8679 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5428 -0.7488 0.0833 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0347 -0.7218 -0.0031 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8839 -0.9535 1.2334 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2535 -0.7344 -0.0806 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5967 -0.9606 1.2274 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4710 -0.5435 -1.1484 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6778 0.3939 -0.0925 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1992 0.5000 0.0164 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3328 0.7644 0.1476 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3885 1.4710 -0.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2909 -0.7787 0.2963 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1238 -0.3640 -0.7111 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7760 1.3708 -0.6815 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6785 -0.8788 0.1939 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4210 0.1959 -0.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0064 0.4419 -0.0212 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6511 -1.4544 -1.5823 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4327 1.4237 0.7603 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3534 -1.0919 -0.9837 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4785 -1.3730 0.7586 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3922 -1.1147 2.1768 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8423 -0.3707 -2.1489 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8973 2.3894 -0.8864 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7374 -1.6242 0.6936 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3418 2.2160 -1.0651 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1681 -1.7992 0.5019 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0803 0.3206 -0.0821 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2362 -2.1655 -0.9905 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8344 -2.0050 -2.0607 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2853 -1.0383 -2.3715 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0462 2.1058 1.3391 H 0 0 0 0 0 0 0 0 0 0 0 0 1 23 1 0 0 0 0 2 10 1 0 0 0 0 2 17 1 0 0 0 0 3 9 1 0 0 0 0 3 14 1 0 0 0 0 4 12 1 0 0 0 0 4 16 1 0 0 0 0 5 13 2 0 0 0 0 6 16 2 0 0 0 0 7 17 1 0 0 0 0 7 20 2 0 0 0 0 8 17 2 0 0 0 0 8 26 1 0 0 0 0 9 10 1 0 0 0 0 9 11 2 0 0 0 0 10 27 1 0 0 0 0 10 28 1 0 0 0 0 11 13 1 0 0 0 0 11 29 1 0 0 0 0 12 13 1 0 0 0 0 12 14 2 0 0 0 0 14 30 1 0 0 0 0 15 16 1 0 0 0 0 15 18 2 0 0 0 0 15 19 1 0 0 0 0 18 21 1 0 0 0 0 18 31 1 0 0 0 0 19 22 2 0 0 0 0 19 32 1 0 0 0 0 20 24 1 0 0 0 0 20 25 1 0 0 0 0 21 23 2 0 0 0 0 21 33 1 0 0 0 0 22 23 1 0 0 0 0 22 34 1 0 0 0 0 24 26 2 0 0 0 0 24 35 1 0 0 0 0 25 36 1 0 0 0 0 25 37 1 0 0 0 0 25 38 1 0 0 0 0 26 39 1 0 0 0 0 M END $$$$