B1ENI2 -OEChem-04022117323D 60 64 0 1 0 0 0 0 0999 V2000 5.8808 2.4305 1.3497 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4815 -3.4853 0.1048 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1812 -1.1043 -1.3733 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8314 1.8188 -1.4384 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0112 -0.3704 0.8198 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.7127 1.9758 -0.8168 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.1120 4.2862 -0.4871 N 0 0 0 0 0 0 0 0 0 0 0 0 7.4212 0.6184 0.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1609 1.4104 0.3902 C 0 0 2 0 0 0 0 0 0 0 0 0 7.7884 -0.3941 -0.2752 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6129 1.5923 0.9248 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4334 2.0516 -0.9943 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0467 0.3628 -1.5886 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7595 2.3391 -0.4108 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9751 0.5361 0.3388 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0084 -0.1757 0.2977 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8572 -1.0235 0.2492 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7427 -2.0960 1.1336 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8495 -0.7779 -0.6834 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6206 -2.9231 1.0854 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7273 -1.6050 -0.7318 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6130 -2.6776 0.1525 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7234 -2.8813 0.0012 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6647 -3.3733 -0.9032 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0330 -1.7811 0.8008 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2251 -1.6648 -0.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9155 -2.7650 -1.0077 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2838 -1.1728 0.6961 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5298 -1.0316 -0.3162 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2975 0.2860 0.8773 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2222 1.7115 0.4121 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6687 2.6679 1.2386 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6398 3.9510 0.7315 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6269 3.2646 -1.1977 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2715 0.1163 1.7908 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6880 -0.9514 0.0134 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9914 -1.1330 -0.4138 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4613 2.3086 1.7403 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5333 1.0400 1.1504 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7577 1.6598 -1.7663 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2520 3.1339 -0.9668 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0712 0.1747 -1.9338 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3947 -0.0287 -2.3794 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5841 3.4121 -0.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7927 2.2572 -0.7704 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1364 2.9626 1.0196 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5199 -2.3003 1.8662 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9269 0.0513 -1.3827 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5367 -3.7570 1.7769 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0308 -1.4040 -1.4841 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4287 -4.2303 -1.5278 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3241 -1.3872 1.5242 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6363 -3.1665 -1.7153 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4723 -0.3026 1.3178 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0106 -0.2741 0.2616 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6528 0.2420 1.9128 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4738 -0.3778 1.6801 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2791 2.4392 2.2223 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2234 4.7698 1.3086 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0132 3.5052 -2.1805 H 0 0 0 0 0 0 0 0 0 0 0 0 1 9 1 0 0 0 0 1 46 1 0 0 0 0 2 22 1 0 0 0 0 2 23 1 0 0 0 0 3 29 2 0 0 0 0 4 12 1 0 0 0 0 4 13 1 0 0 0 0 4 14 1 0 0 0 0 5 29 1 0 0 0 0 5 30 1 0 0 0 0 5 57 1 0 0 0 0 6 31 2 0 0 0 0 6 34 1 0 0 0 0 7 33 1 0 0 0 0 7 34 2 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 11 1 0 0 0 0 8 35 1 0 0 0 0 9 12 1 0 0 0 0 9 15 1 0 0 0 0 10 13 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 11 14 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 40 1 0 0 0 0 12 41 1 0 0 0 0 13 42 1 0 0 0 0 13 43 1 0 0 0 0 14 44 1 0 0 0 0 14 45 1 0 0 0 0 15 16 3 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 18 20 1 0 0 0 0 18 47 1 0 0 0 0 19 21 2 0 0 0 0 19 48 1 0 0 0 0 20 22 2 0 0 0 0 20 49 1 0 0 0 0 21 22 1 0 0 0 0 21 50 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 24 27 1 0 0 0 0 24 51 1 0 0 0 0 25 28 2 0 0 0 0 25 52 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 26 29 1 0 0 0 0 27 53 1 0 0 0 0 28 54 1 0 0 0 0 30 31 1 0 0 0 0 30 55 1 0 0 0 0 30 56 1 0 0 0 0 31 32 1 0 0 0 0 32 33 2 0 0 0 0 32 58 1 0 0 0 0 33 59 1 0 0 0 0 34 60 1 0 0 0 0 M END $$$$