B5FMI2 -OEChem-04042104563D 39 41 0 0 0 0 0 0 0999 V2000 3.4050 1.1521 2.0901 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.9027 -1.2897 -0.5145 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5372 0.6240 -0.6109 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.5537 -1.4165 0.3190 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1428 2.7121 -0.3147 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1312 0.4769 -0.1272 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3302 -0.9023 0.0923 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7431 0.1222 -0.3781 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8398 0.9792 -0.3607 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2526 1.3170 -0.1044 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2158 -1.7366 0.0694 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9318 -1.2374 -0.1628 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9163 0.8546 -0.9450 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6099 -0.5715 0.3331 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5147 0.7902 0.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2262 0.3639 -0.3862 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7511 -0.0816 -0.6660 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5248 0.4615 0.9728 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1515 -0.1993 -1.2649 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9478 -1.1823 0.5865 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7487 -0.0042 1.4531 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3756 -0.6649 -0.7846 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6742 -0.5673 0.5744 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6578 2.0361 -0.5326 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3385 -2.8055 0.2356 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1376 -1.9707 -0.1593 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7115 1.8633 -0.5665 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9820 0.9611 -2.0358 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5832 1.6290 -0.7645 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3966 1.4227 0.1508 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9342 -0.2855 -2.3263 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8654 -2.2647 0.7304 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3967 -0.7554 1.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6146 -1.0050 -0.2634 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9798 3.2807 -0.2897 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2586 3.1638 -0.4907 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9967 0.0643 2.5093 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0959 -1.1040 -1.4685 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6272 -0.9301 0.9483 H 0 0 0 0 0 0 0 0 0 0 0 0 1 18 1 0 0 0 0 2 17 2 0 0 0 0 3 8 1 0 0 0 0 3 17 1 0 0 0 0 3 29 1 0 0 0 0 4 7 2 0 0 0 0 4 14 1 0 0 0 0 5 10 1 0 0 0 0 5 35 1 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 9 1 0 0 0 0 6 10 2 0 0 0 0 7 11 1 0 0 0 0 8 9 2 0 0 0 0 8 12 1 0 0 0 0 9 24 1 0 0 0 0 10 15 1 0 0 0 0 11 12 2 0 0 0 0 11 25 1 0 0 0 0 12 26 1 0 0 0 0 13 16 1 0 0 0 0 13 17 1 0 0 0 0 13 27 1 0 0 0 0 13 28 1 0 0 0 0 14 15 2 0 0 0 0 14 20 1 0 0 0 0 15 30 1 0 0 0 0 16 18 1 0 0 0 0 16 19 2 0 0 0 0 18 21 2 0 0 0 0 19 22 1 0 0 0 0 19 31 1 0 0 0 0 20 32 1 0 0 0 0 20 33 1 0 0 0 0 20 34 1 0 0 0 0 21 23 1 0 0 0 0 21 37 1 0 0 0 0 22 23 2 0 0 0 0 22 38 1 0 0 0 0 23 39 1 0 0 0 0 M END $$$$