B1HWB0 -OEChem-04022108273D 57 60 0 0 0 0 0 0 0999 V2000 3.7715 -0.2012 -2.2186 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -5.8313 0.8339 -0.7898 S 0 0 0 0 0 0 0 0 0 0 0 0 0.7630 2.8319 -1.6561 S 0 0 0 0 0 0 0 0 0 0 0 0 2.9747 1.1676 0.3394 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7474 -2.0689 -0.4609 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7296 -1.1470 -1.2480 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0363 2.2918 0.7652 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3437 1.6802 -0.2705 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.9238 1.7799 1.5462 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2418 -4.4072 1.1643 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1991 -3.5499 0.5306 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0865 -5.1712 0.1271 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1656 -3.6116 2.1062 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5732 -2.5019 -0.3105 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1512 -3.7968 0.7790 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7530 -1.9480 -0.6551 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4028 -1.7010 -0.9034 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1273 -2.9959 0.1861 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1226 -1.2406 -1.1187 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8551 -0.1864 -1.9208 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1072 2.3807 -0.0044 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0819 2.5118 -0.0006 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4109 2.1867 0.5622 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4833 2.4997 0.4726 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9144 2.6661 -1.3397 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5607 1.5051 0.2789 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6551 2.5104 1.8812 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3219 1.0274 0.1449 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9423 2.2834 2.3233 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8275 0.4119 -1.0001 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1947 1.5153 1.1175 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2058 0.2842 -1.1726 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5730 1.3875 0.9451 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0785 0.7720 -0.1999 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7474 -5.1681 1.7837 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6831 -4.4941 -0.4939 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4459 -5.7601 -0.5386 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7763 -5.8602 0.6264 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7646 -2.8719 1.5639 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8567 -4.2848 2.6248 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5818 -3.0790 2.8651 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6188 -2.2909 -0.5166 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4589 -4.6091 1.4322 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0965 -0.8870 -1.5556 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1499 -3.2484 0.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3704 -0.4027 -1.8417 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5268 -0.6952 -2.6195 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1788 0.4386 -2.5112 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5165 2.7833 1.5309 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0992 3.2131 -0.0904 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6420 2.7871 -2.1307 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9032 2.9203 2.5441 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2294 2.5079 3.3449 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8170 1.9890 2.0195 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6153 -0.1931 -2.0592 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2526 1.7653 1.7033 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1516 0.6721 -0.3337 H 0 0 0 0 0 0 0 0 0 0 0 0 1 30 1 0 0 0 0 2 20 1 0 0 0 0 2 26 1 0 0 0 0 3 22 1 0 0 0 0 3 25 1 0 0 0 0 4 24 1 0 0 0 0 4 28 1 0 0 0 0 5 19 2 0 0 0 0 6 16 1 0 0 0 0 6 19 1 0 0 0 0 6 46 1 0 0 0 0 7 21 1 0 0 0 0 7 22 2 0 0 0 0 8 23 2 0 0 0 0 8 26 1 0 0 0 0 9 26 2 0 0 0 0 9 29 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 13 1 0 0 0 0 10 35 1 0 0 0 0 11 14 2 0 0 0 0 11 15 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 17 1 0 0 0 0 14 42 1 0 0 0 0 15 18 2 0 0 0 0 15 43 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 17 44 1 0 0 0 0 18 45 1 0 0 0 0 19 20 1 0 0 0 0 20 47 1 0 0 0 0 20 48 1 0 0 0 0 21 23 1 0 0 0 0 21 25 2 0 0 0 0 22 24 1 0 0 0 0 23 27 1 0 0 0 0 24 49 1 0 0 0 0 24 50 1 0 0 0 0 25 51 1 0 0 0 0 27 29 2 0 0 0 0 27 52 1 0 0 0 0 28 30 1 0 0 0 0 28 31 2 0 0 0 0 29 53 1 0 0 0 0 30 32 2 0 0 0 0 31 33 1 0 0 0 0 31 54 1 0 0 0 0 32 34 1 0 0 0 0 32 55 1 0 0 0 0 33 34 2 0 0 0 0 33 56 1 0 0 0 0 34 57 1 0 0 0 0 M END $$$$