B3PV6F -OEChem-04042106583D 54 57 0 0 0 0 0 0 0999 V2000 6.5419 -1.6642 1.3203 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -6.7697 0.0643 2.2431 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.6756 -0.1769 -2.2552 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9380 0.9411 1.4921 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3487 0.6330 -0.3182 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.5399 -0.0361 -0.1247 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1896 0.5142 1.7234 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1735 3.0506 -0.2551 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1028 1.9710 -0.4835 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2106 -0.0802 -0.5911 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2120 2.1140 -0.8685 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5703 4.4459 -0.5263 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3610 2.8159 -1.2137 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7440 3.0715 1.1812 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7765 0.8162 -0.9367 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5786 0.0888 0.0698 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1456 -1.5274 -0.5053 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1048 0.4919 -1.2924 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8619 -0.1001 1.4223 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5209 -0.2644 -0.8962 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4444 -2.3063 -1.6232 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2156 -2.1393 0.6948 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1970 0.3920 -0.4647 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0874 -0.6423 1.8091 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7465 -0.8066 -0.5095 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3819 -3.6974 -1.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2781 -3.5303 0.7772 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0297 -0.9955 0.8432 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0206 -4.3094 -0.3406 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5141 0.0348 -1.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0184 0.6450 0.9904 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4408 0.1862 1.2359 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7221 3.0441 -1.0795 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7389 4.6637 0.1546 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1984 4.5298 -1.5545 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3166 5.2379 -0.3913 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0354 2.4385 -2.1897 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1319 2.1587 -0.8097 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8836 3.7624 -1.4045 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9522 2.9222 1.9239 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5269 2.3330 1.3548 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2148 4.0385 1.3982 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2508 0.3028 -2.3546 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1351 0.1645 2.1866 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3111 -0.1340 -1.9552 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7277 -1.8443 -2.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4489 -1.5477 1.5766 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2939 -0.7848 2.8667 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4702 -1.0792 -1.2733 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6147 -4.3039 -2.4112 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5587 -4.0069 1.7119 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0278 -5.3925 -0.2764 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4607 -0.2772 -0.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1190 0.6772 2.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 1 28 1 0 0 0 0 2 32 2 0 0 0 0 3 30 2 0 0 0 0 4 31 2 0 0 0 0 5 9 1 0 0 0 0 5 10 1 0 0 0 0 5 16 1 0 0 0 0 6 30 1 0 0 0 0 6 32 1 0 0 0 0 6 53 1 0 0 0 0 7 31 1 0 0 0 0 7 32 1 0 0 0 0 7 54 1 0 0 0 0 8 9 1 0 0 0 0 8 12 1 0 0 0 0 8 13 1 0 0 0 0 8 14 1 0 0 0 0 9 11 2 0 0 0 0 10 15 2 0 0 0 0 10 17 1 0 0 0 0 11 15 1 0 0 0 0 11 33 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 15 18 1 0 0 0 0 16 19 2 0 0 0 0 16 20 1 0 0 0 0 17 21 2 0 0 0 0 17 22 1 0 0 0 0 18 23 2 0 0 0 0 18 43 1 0 0 0 0 19 24 1 0 0 0 0 19 44 1 0 0 0 0 20 25 2 0 0 0 0 20 45 1 0 0 0 0 21 26 1 0 0 0 0 21 46 1 0 0 0 0 22 27 2 0 0 0 0 22 47 1 0 0 0 0 23 30 1 0 0 0 0 23 31 1 0 0 0 0 24 28 2 0 0 0 0 24 48 1 0 0 0 0 25 28 1 0 0 0 0 25 49 1 0 0 0 0 26 29 2 0 0 0 0 26 50 1 0 0 0 0 27 29 1 0 0 0 0 27 51 1 0 0 0 0 29 52 1 0 0 0 0 M END $$$$