BJ1BW8 -OEChem-04022109352D 51 54 0 0 0 0 0 0 0999 V2000 12.1187 -3.7517 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 10.1469 3.8087 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 10.7868 2.5475 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 8.8857 3.1688 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -0.7106 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 0.7894 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0309 -3.8087 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9473 -0.4059 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.9473 -2.0153 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.0309 -2.0766 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.5309 -1.2106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -0.7106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2579 0.5447 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5309 -1.2106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -1.7106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2364 0.7509 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0309 -2.0766 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -0.2106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -2.2106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -0.7106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5471 1.7014 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -1.7106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9043 0.0066 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5256 1.9076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8828 0.2128 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1934 1.1633 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -0.2106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8363 2.8581 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5309 -2.9426 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5309 -2.9426 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1187 -2.1336 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0697 -2.4426 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0697 -3.4426 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2374 1.1643 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6441 0.6320 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1135 -0.9985 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4232 -0.6000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4483 -2.2887 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1385 -2.6872 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 0.4094 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -2.8306 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1330 2.1629 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.0206 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7117 -0.5827 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3409 -1.5397 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2968 -0.2487 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8001 1.2912 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9271 -1.5440 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.4006 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5713 -2.0782 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5713 -3.8071 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 30 1 0 0 0 0 1 33 1 0 0 0 0 2 28 1 0 0 0 0 3 28 1 0 0 0 0 4 28 1 0 0 0 0 5 27 1 0 0 0 0 5 49 1 0 0 0 0 6 27 2 0 0 0 0 7 29 2 0 0 0 0 8 11 1 0 0 0 0 8 12 1 0 0 0 0 8 13 1 0 0 0 0 9 11 2 0 0 0 0 9 15 1 0 0 0 0 10 17 1 0 0 0 0 10 29 1 0 0 0 0 10 45 1 0 0 0 0 11 14 1 0 0 0 0 12 15 2 0 0 0 0 12 18 1 0 0 0 0 13 16 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 14 17 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 15 19 1 0 0 0 0 16 21 2 0 0 0 0 16 23 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 18 20 2 0 0 0 0 18 40 1 0 0 0 0 19 22 2 0 0 0 0 19 41 1 0 0 0 0 20 22 1 0 0 0 0 20 27 1 0 0 0 0 21 24 1 0 0 0 0 21 42 1 0 0 0 0 22 43 1 0 0 0 0 23 25 2 0 0 0 0 23 44 1 0 0 0 0 24 26 2 0 0 0 0 24 28 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 26 47 1 0 0 0 0 29 30 1 0 0 0 0 30 31 2 0 0 0 0 31 32 1 0 0 0 0 31 48 1 0 0 0 0 32 33 2 0 0 0 0 32 50 1 0 0 0 0 33 51 1 0 0 0 0 M END $$$$