BEJ2I4 -OEChem-04022101573D 52 55 0 1 0 0 0 0 0999 V2000 5.9541 0.0593 -0.1183 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.6673 0.5690 -2.1599 F 0 0 0 0 0 0 0 0 0 0 0 0 -7.3328 -1.7813 2.7339 F 0 0 0 0 0 0 0 0 0 0 0 0 8.5458 -1.1971 -1.0518 F 0 0 0 0 0 0 0 0 0 0 0 0 8.5172 -1.0396 1.1219 F 0 0 0 0 0 0 0 0 0 0 0 0 8.4202 -3.0018 0.1641 F 0 0 0 0 0 0 0 0 0 0 0 0 -3.8573 1.1623 0.2907 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3829 0.5289 -1.4225 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3478 0.7648 1.0850 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2350 1.1474 -0.4701 N 0 0 2 0 0 0 0 0 0 0 0 0 -3.7472 -2.0553 -1.6134 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7103 2.7821 0.8676 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8369 2.0394 0.7112 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2371 -0.1887 -0.1377 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5242 0.6055 -0.0682 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.9300 -0.5463 -0.9914 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3406 -1.0413 -0.6401 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.5910 1.6970 -0.0947 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3295 0.1451 -0.6065 C 0 0 1 0 0 0 0 0 0 0 0 0 0.8598 0.1101 -0.4471 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1768 2.3330 0.3572 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0122 0.8944 0.0136 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6172 2.1132 0.4571 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7182 -0.2456 -0.1419 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3923 0.8815 0.1857 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8230 -0.0067 -0.9593 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8905 -0.8450 1.1058 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1674 -1.2057 1.5359 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1000 -0.3672 -0.5291 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5066 -1.6251 0.0307 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2722 -0.9666 0.7185 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0086 -1.7197 0.0729 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4690 0.2093 0.9561 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9057 -0.2093 -2.0377 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2308 -1.3879 -0.9133 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2803 -1.5122 0.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3788 2.4997 0.6174 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6827 2.1578 -1.0866 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3938 0.5935 -1.6074 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0121 -0.3027 -1.4482 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6592 -0.6928 0.2716 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2583 2.3174 1.3629 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0731 3.2648 -0.1572 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6447 -2.4550 -1.3433 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0790 -2.8249 -1.6071 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7913 3.7149 1.2544 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8500 -0.9510 -0.7079 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0454 -1.0295 1.7629 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9598 -0.1810 -1.1657 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1155 -2.1792 -0.8276 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0759 -2.0329 0.9499 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2662 -1.2474 1.0537 H 0 0 0 0 0 0 0 0 0 0 0 0 1 8 2 0 0 0 0 1 9 2 0 0 0 0 1 14 1 0 0 0 0 1 30 1 0 0 0 0 2 26 1 0 0 0 0 3 28 1 0 0 0 0 4 32 1 0 0 0 0 5 32 1 0 0 0 0 6 32 1 0 0 0 0 7 18 1 0 0 0 0 7 19 1 0 0 0 0 10 15 1 0 0 0 0 10 20 1 0 0 0 0 10 21 1 0 0 0 0 11 17 1 0 0 0 0 11 44 1 0 0 0 0 11 45 1 0 0 0 0 12 13 1 0 0 0 0 12 23 1 0 0 0 0 12 46 1 0 0 0 0 13 25 2 0 0 0 0 14 25 1 0 0 0 0 14 47 1 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 15 33 1 0 0 0 0 16 17 1 0 0 0 0 16 34 1 0 0 0 0 16 35 1 0 0 0 0 17 19 1 0 0 0 0 17 36 1 0 0 0 0 18 37 1 0 0 0 0 18 38 1 0 0 0 0 19 24 1 0 0 0 0 19 39 1 0 0 0 0 20 22 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 21 23 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 24 26 2 0 0 0 0 24 27 1 0 0 0 0 26 29 1 0 0 0 0 27 28 2 0 0 0 0 27 48 1 0 0 0 0 28 31 1 0 0 0 0 29 31 2 0 0 0 0 29 49 1 0 0 0 0 30 32 1 0 0 0 0 30 50 1 0 0 0 0 30 51 1 0 0 0 0 31 52 1 0 0 0 0 M END $$$$