B9C7SU -OEChem-04042103123D 50 53 0 1 0 0 0 0 0999 V2000 0.2588 0.9173 -0.9570 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.6464 1.4615 -0.2705 S 0 0 0 0 0 0 0 0 0 0 0 0 2.9574 -2.6697 -0.4482 F 0 0 0 0 0 0 0 0 0 0 0 0 1.4615 -3.2856 1.0045 F 0 0 0 0 0 0 0 0 0 0 0 0 1.2006 -3.7776 -1.0915 F 0 0 0 0 0 0 0 0 0 0 0 0 3.2473 -0.0576 -2.2460 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7891 2.6399 -1.1113 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.4887 0.2984 -0.4988 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6386 -0.7955 2.2775 O 0 5 0 0 0 0 0 0 0 0 0 0 -6.0720 -1.9630 0.4695 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6448 0.4885 0.0001 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4771 -1.4732 -0.3036 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.4679 -1.0366 1.0594 N 0 3 0 0 0 0 0 0 0 0 0 0 3.2172 0.6354 1.4258 C 0 0 2 0 0 0 0 0 0 0 0 0 4.3177 1.4645 2.1206 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4480 1.3501 1.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0179 0.8264 -0.0724 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0672 -0.7325 2.0999 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8796 0.0575 -1.0788 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7576 1.7639 1.3378 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8990 0.7112 -1.1377 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4721 -0.2874 -0.8229 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6521 1.6383 0.2756 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2247 1.1175 -0.9536 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8942 -1.4885 -0.4689 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9194 -0.2571 -0.5354 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3036 0.1473 -0.4641 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9777 0.9300 -0.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6041 -2.7670 -0.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2200 -0.6223 0.2525 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5570 -0.2309 0.3208 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7244 1.3083 -1.1129 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0615 1.6997 -1.0449 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8786 1.9886 1.4106 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2593 1.1645 1.4737 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5832 1.0928 3.1144 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0131 2.5145 2.1955 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0771 -0.6312 3.1909 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1077 -1.1840 1.8583 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8656 -1.4245 1.8134 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0817 2.1844 2.2838 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6065 0.3078 -2.0992 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6847 1.9533 0.3973 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9328 1.0294 -1.7735 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8996 -1.5280 0.7645 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0696 1.9371 -1.7084 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3575 2.6065 -1.5639 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7847 2.5999 1.4386 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0193 1.1376 2.0705 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0267 2.5979 1.7182 H 0 0 0 0 0 0 0 0 0 0 0 0 1 22 1 0 0 0 0 1 26 1 0 0 0 0 2 7 2 0 0 0 0 2 8 2 0 0 0 0 2 28 1 0 0 0 0 2 34 1 0 0 0 0 3 29 1 0 0 0 0 4 29 1 0 0 0 0 5 29 1 0 0 0 0 6 19 2 0 0 0 0 9 13 1 0 0 0 0 10 13 2 0 0 0 0 11 14 1 0 0 0 0 11 17 1 0 0 0 0 11 19 1 0 0 0 0 12 25 1 0 0 0 0 12 26 2 0 0 0 0 13 31 1 0 0 0 0 14 15 1 0 0 0 0 14 18 1 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 20 2 0 0 0 0 17 21 2 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 19 22 1 0 0 0 0 20 23 1 0 0 0 0 20 41 1 0 0 0 0 21 24 1 0 0 0 0 21 42 1 0 0 0 0 22 25 2 0 0 0 0 23 24 2 0 0 0 0 23 43 1 0 0 0 0 24 44 1 0 0 0 0 25 29 1 0 0 0 0 26 27 1 0 0 0 0 27 30 2 0 0 0 0 27 32 1 0 0 0 0 28 31 2 0 0 0 0 28 33 1 0 0 0 0 30 31 1 0 0 0 0 30 45 1 0 0 0 0 32 33 2 0 0 0 0 32 46 1 0 0 0 0 33 47 1 0 0 0 0 34 48 1 0 0 0 0 34 49 1 0 0 0 0 34 50 1 0 0 0 0 M CHG 2 9 -1 13 1 M END $$$$