B5HMI7 -OEChem-04022102413D 51 54 0 0 0 0 0 0 0999 V2000 -0.6179 3.4032 -0.1661 S 0 0 0 0 0 0 0 0 0 0 0 0 -9.6092 -1.8797 1.2248 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.9044 -1.7866 -0.9340 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9243 0.9350 -0.2567 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5432 1.9880 -0.0563 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9015 1.7103 0.2311 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1641 0.0197 0.2713 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6849 1.8049 -0.7549 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1710 0.4297 -0.8181 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9784 1.2720 -1.3113 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0477 3.2579 0.2556 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5248 1.1621 -0.6404 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4701 -0.5538 -0.2924 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4377 0.4045 -0.0816 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7158 2.6869 0.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8658 4.2445 0.8399 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3830 -0.6181 0.8661 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4549 -0.9457 0.8058 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8992 -1.8916 0.5766 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0078 0.1684 -1.3291 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4789 -2.1316 -0.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2011 3.9400 1.1112 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5254 -1.0908 -1.6337 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8528 -2.9325 1.5185 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9952 -3.4052 -0.9813 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7117 -1.5723 0.2557 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3705 -4.1916 1.2139 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9406 -4.4276 -0.0335 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7000 -0.7300 0.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3941 0.8897 0.8995 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6346 1.2003 -1.4459 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9696 -0.4401 -1.4558 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4106 2.0204 -1.9883 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7586 0.3839 -1.9181 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6740 0.1384 -0.9621 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9368 0.1840 -0.9571 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2399 -1.4301 -0.9116 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5180 0.2263 0.3541 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7597 2.4776 1.0336 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4717 5.2282 1.0785 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9353 -0.4278 1.8409 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9874 -1.6699 1.4821 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7392 -0.0568 1.3796 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0579 0.9544 -2.0791 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8416 4.6933 1.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9663 -1.2528 -2.6151 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4118 -2.7709 2.4999 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4455 -3.6123 -1.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3284 -4.9880 1.9512 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3435 -5.4082 -0.2699 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4210 -2.2885 0.8557 H 0 0 0 0 0 0 0 0 0 0 0 0 1 8 1 0 0 0 0 1 11 1 0 0 0 0 2 26 1 0 0 0 0 2 51 1 0 0 0 0 3 26 2 0 0 0 0 4 9 1 0 0 0 0 4 10 1 0 0 0 0 4 38 1 0 0 0 0 5 6 2 0 0 0 0 5 11 1 0 0 0 0 5 12 1 0 0 0 0 6 14 1 0 0 0 0 6 15 1 0 0 0 0 7 9 1 0 0 0 0 7 13 1 0 0 0 0 7 29 1 0 0 0 0 7 30 1 0 0 0 0 8 10 1 0 0 0 0 8 12 2 0 0 0 0 9 31 1 0 0 0 0 9 32 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 11 16 2 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 17 2 0 0 0 0 14 20 1 0 0 0 0 15 22 2 0 0 0 0 15 39 1 0 0 0 0 16 22 1 0 0 0 0 16 40 1 0 0 0 0 17 19 1 0 0 0 0 17 41 1 0 0 0 0 18 26 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 19 21 1 0 0 0 0 19 24 2 0 0 0 0 20 23 2 0 0 0 0 20 44 1 0 0 0 0 21 23 1 0 0 0 0 21 25 2 0 0 0 0 22 45 1 0 0 0 0 23 46 1 0 0 0 0 24 27 1 0 0 0 0 24 47 1 0 0 0 0 25 28 1 0 0 0 0 25 48 1 0 0 0 0 27 28 2 0 0 0 0 27 49 1 0 0 0 0 28 50 1 0 0 0 0 M END $$$$