B4MBT8 -OEChem-04022109333D 49 52 0 0 0 0 0 0 0999 V2000 4.9111 1.0617 2.6139 Cl 0 0 0 0 0 0 0 0 0 0 0 0 5.1392 4.0374 1.3615 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -3.9982 0.5826 -1.1810 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.2700 3.1000 2.4768 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2941 1.4000 -2.3485 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7808 -0.6164 -0.9192 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6195 -2.9651 -0.1993 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0294 1.5762 0.2130 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6709 -1.0652 -1.2558 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5485 -5.2106 1.5005 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6547 -3.6364 1.3302 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6050 0.9161 1.4822 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3846 2.9137 0.0636 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3086 0.1389 -1.2343 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5303 -1.3293 -0.6316 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3698 -0.5274 -1.3435 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9274 1.8421 2.6465 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7159 3.7557 1.2877 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8748 -1.0098 -0.5668 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2568 -2.4227 -0.0725 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4030 0.9428 -1.9486 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0468 0.6131 -2.0091 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6868 -2.2368 -0.4876 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8362 -0.4831 -1.8775 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4128 0.6336 -1.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1554 -3.4409 0.6853 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8506 0.3892 0.2456 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5105 1.9163 -1.5955 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3863 1.4272 1.0077 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0463 2.9544 -0.8333 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4842 2.7098 0.4683 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7838 -4.4176 1.1357 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5339 -3.5494 1.0415 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5249 0.7395 1.4684 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1322 -0.0330 1.6169 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7548 3.4222 -0.8312 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2988 2.7946 -0.0075 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5719 1.4032 3.5841 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0073 2.0071 2.7425 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7924 3.9507 1.3629 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2049 4.7218 1.2273 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5987 -1.5975 -0.0289 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7398 1.8376 -2.4657 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6368 1.2419 -2.5668 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5775 -0.1581 -2.8919 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6036 -1.2596 -1.9874 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7859 -0.6111 0.6656 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1747 2.1216 -2.6084 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1153 3.9477 -1.2697 H 0 0 0 0 0 0 0 0 0 0 0 0 1 29 1 0 0 0 0 2 31 1 0 0 0 0 3 5 2 0 0 0 0 3 6 2 0 0 0 0 3 8 1 0 0 0 0 3 14 1 0 0 0 0 4 17 1 0 0 0 0 4 18 1 0 0 0 0 7 23 2 0 0 0 0 8 12 1 0 0 0 0 8 13 1 0 0 0 0 9 16 1 0 0 0 0 9 23 1 0 0 0 0 9 24 1 0 0 0 0 10 32 3 0 0 0 0 11 33 3 0 0 0 0 12 17 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 13 18 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 19 2 0 0 0 0 14 21 1 0 0 0 0 15 16 2 0 0 0 0 15 19 1 0 0 0 0 15 20 1 0 0 0 0 16 22 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 19 42 1 0 0 0 0 20 23 1 0 0 0 0 20 26 2 0 0 0 0 21 22 2 0 0 0 0 21 43 1 0 0 0 0 22 44 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 25 27 2 0 0 0 0 25 28 1 0 0 0 0 26 32 1 0 0 0 0 26 33 1 0 0 0 0 27 29 1 0 0 0 0 27 47 1 0 0 0 0 28 30 2 0 0 0 0 28 48 1 0 0 0 0 29 31 2 0 0 0 0 30 31 1 0 0 0 0 30 49 1 0 0 0 0 M END $$$$