BAFT60 -OEChem-04022108393D 46 49 0 0 0 0 0 0 0999 V2000 -0.2288 3.7255 -0.9149 S 0 0 0 0 0 0 0 0 0 0 0 0 2.6005 -1.8394 -0.2939 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4385 -1.1968 -0.6161 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.6565 -3.3240 0.0510 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8296 -1.5378 0.5406 O 0 5 0 0 0 0 0 0 0 0 0 0 8.3550 0.6053 0.5031 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2594 1.3020 -0.0159 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0045 -0.5979 0.4421 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.5094 1.2537 0.3091 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4020 4.7800 0.7479 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3424 -0.1721 -0.0393 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0307 0.5571 -0.3352 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9532 -1.5032 -0.1075 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3272 0.8605 -0.1572 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6946 0.1270 0.1441 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0189 1.5775 -0.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8733 -2.5439 0.0017 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6069 -0.8725 -0.4265 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6305 -0.9055 0.2551 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2201 -2.2384 0.1841 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2344 2.8324 -0.9652 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0060 2.3657 -0.2138 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3792 2.4775 0.1008 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3028 0.0995 0.2433 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1786 1.3822 0.0546 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6676 0.1633 0.5445 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7369 -1.1261 -0.1236 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8861 -2.2039 0.1135 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4568 -0.9850 0.4799 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5262 -2.2744 -0.1882 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9547 3.7485 0.4602 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0092 -4.5370 -0.3303 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6693 1.8883 -0.0776 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9983 1.1704 0.1981 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5515 -3.5793 -0.0543 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9234 -3.0631 0.2671 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1361 3.2719 -1.3686 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9949 2.1020 0.5811 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7020 0.4525 -0.2323 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1265 1.1062 0.8318 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6882 -1.2490 -0.3699 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5157 -0.9240 0.7161 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0197 -3.1884 -0.4795 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7702 -5.3241 -0.3279 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2437 -4.8302 0.3962 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6132 -4.4785 -1.3499 H 0 0 0 0 0 0 0 0 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 13 1 0 0 0 0 2 18 1 0 0 0 0 3 18 2 0 0 0 0 4 28 1 0 0 0 0 4 32 1 0 0 0 0 5 8 1 0 0 0 0 6 8 2 0 0 0 0 7 16 1 0 0 0 0 7 22 2 0 0 0 0 8 19 1 0 0 0 0 9 24 1 0 0 0 0 9 25 1 0 0 0 0 9 38 1 0 0 0 0 10 31 3 0 0 0 0 11 13 2 0 0 0 0 11 14 1 0 0 0 0 11 15 1 0 0 0 0 12 14 2 0 0 0 0 12 16 1 0 0 0 0 12 18 1 0 0 0 0 13 17 1 0 0 0 0 14 33 1 0 0 0 0 15 19 2 0 0 0 0 15 34 1 0 0 0 0 16 21 2 0 0 0 0 17 20 2 0 0 0 0 17 35 1 0 0 0 0 19 20 1 0 0 0 0 20 36 1 0 0 0 0 21 37 1 0 0 0 0 22 23 1 0 0 0 0 23 25 2 0 0 0 0 23 31 1 0 0 0 0 24 26 2 0 0 0 0 24 27 1 0 0 0 0 25 39 1 0 0 0 0 26 29 1 0 0 0 0 26 40 1 0 0 0 0 27 30 2 0 0 0 0 27 41 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 29 42 1 0 0 0 0 30 43 1 0 0 0 0 32 44 1 0 0 0 0 32 45 1 0 0 0 0 32 46 1 0 0 0 0 M CHG 2 5 -1 8 1 M END $$$$