B1HNA5 -OEChem-04042106233D 40 43 0 1 0 0 0 0 0999 V2000 -7.5440 -1.8539 0.3314 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -4.9125 1.3989 -0.3142 S 0 0 0 0 0 0 0 0 0 0 0 0 4.4433 -0.6156 1.7825 F 0 0 0 0 0 0 0 0 0 0 0 0 2.7034 0.4382 2.5581 F 0 0 0 0 0 0 0 0 0 0 0 0 3.3716 2.5831 -0.2969 F 0 0 0 0 0 0 0 0 0 0 0 0 2.5201 -2.4269 -1.4025 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9715 -1.0490 0.3007 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0355 -1.3636 0.6416 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2960 -3.5285 0.1298 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9884 1.2445 -0.2176 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6057 -0.2183 -0.9324 C 0 0 2 0 0 0 0 0 0 0 0 0 3.4099 -1.3888 -1.8392 C 0 0 1 0 0 0 0 0 0 0 0 0 4.6909 -1.2611 -1.0614 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7186 -0.1109 0.2832 C 0 0 1 0 0 0 0 0 0 0 0 0 1.6832 0.9414 0.0039 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5323 0.3367 1.5002 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9585 -2.3687 -0.1606 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3295 0.6059 0.0235 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0730 2.2512 -0.2754 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6344 1.5801 -0.2363 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1092 3.2256 -0.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2444 2.8900 -0.5155 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5635 -0.0070 0.0406 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0495 -0.0428 0.0161 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8915 -1.1120 0.2291 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2633 -0.7428 0.1193 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4175 0.5944 -0.1731 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8634 0.7249 -1.3989 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4612 -1.2062 -2.9063 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5858 -0.9900 -1.6089 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8660 -1.9499 -0.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0718 1.2789 1.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0426 -0.4069 0.2418 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8188 -3.6545 1.0158 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2615 -4.2956 -0.5327 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4133 4.2452 -0.7525 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9848 3.6594 -0.7198 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6285 2.0111 -0.4134 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5400 -2.1120 0.4528 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3389 1.1431 -0.3117 H 0 0 0 0 0 0 0 0 0 0 0 0 1 26 1 0 0 0 0 2 24 1 0 0 0 0 2 27 1 0 0 0 0 3 16 1 0 0 0 0 4 16 1 0 0 0 0 5 19 1 0 0 0 0 6 12 1 0 0 0 0 6 17 1 0 0 0 0 7 23 2 0 0 0 0 8 14 1 0 0 0 0 8 17 2 0 0 0 0 9 17 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 10 20 1 0 0 0 0 10 23 1 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 14 1 0 0 0 0 11 28 1 0 0 0 0 12 13 1 0 0 0 0 12 29 1 0 0 0 0 13 30 1 0 0 0 0 13 31 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 15 18 1 0 0 0 0 15 19 2 0 0 0 0 16 32 1 0 0 0 0 18 20 2 0 0 0 0 18 33 1 0 0 0 0 19 21 1 0 0 0 0 20 22 1 0 0 0 0 21 22 2 0 0 0 0 21 36 1 0 0 0 0 22 37 1 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 25 26 1 0 0 0 0 25 39 1 0 0 0 0 26 27 2 0 0 0 0 27 40 1 0 0 0 0 M END $$$$