B3Y2CU -OEChem-04012115373D 42 45 0 1 0 0 0 0 0999 V2000 -2.9437 0.0720 0.0442 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6084 2.1376 -1.6688 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7797 -0.7487 0.5295 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6729 1.2366 -0.8124 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8035 -1.9500 0.7406 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9460 0.0690 -0.3308 C 0 0 2 0 0 0 0 0 0 0 0 0 0.6773 0.4661 0.3884 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1270 -0.8942 0.2219 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7676 0.0457 -0.5906 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0270 1.2280 -1.0865 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5628 0.0806 -0.1209 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7463 1.2187 1.5609 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7339 0.4475 0.5422 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1221 -0.1107 -0.8899 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4247 1.5858 2.2239 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6648 1.2001 1.7148 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1007 0.4820 0.7717 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8118 -1.1980 -0.3734 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1144 -2.0790 0.4313 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3245 -0.0519 0.0871 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9577 0.7043 -0.8993 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8290 -1.3044 0.4372 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0954 0.2080 -1.5358 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9669 -1.8007 -0.1993 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5998 -1.0445 -1.1859 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7002 -0.5155 -1.2267 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3557 -1.4670 1.1054 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1362 2.0356 -1.1376 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6265 -0.5057 -1.0343 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7043 1.5286 1.9701 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6504 0.6034 -1.5149 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3698 2.1727 3.1363 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5311 1.5233 2.2813 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1691 1.5773 0.8088 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0802 0.0864 1.7959 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8636 -1.3469 -0.5881 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6065 -2.9428 0.8662 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5731 1.6805 -1.1827 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3436 -1.9044 1.2024 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5881 0.7964 -2.3043 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3595 -2.7761 0.0727 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4854 -1.4311 -1.6818 H 0 0 0 0 0 0 0 0 0 0 0 0 1 13 1 0 0 0 0 1 17 1 0 0 0 0 2 10 2 0 0 0 0 3 6 1 0 0 0 0 3 8 1 0 0 0 0 3 27 1 0 0 0 0 4 6 1 0 0 0 0 4 10 1 0 0 0 0 4 28 1 0 0 0 0 5 8 1 0 0 0 0 5 19 2 0 0 0 0 6 7 1 0 0 0 0 6 26 1 0 0 0 0 7 11 2 0 0 0 0 7 12 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 11 13 1 0 0 0 0 11 29 1 0 0 0 0 12 15 2 0 0 0 0 12 30 1 0 0 0 0 13 16 2 0 0 0 0 14 18 2 0 0 0 0 14 31 1 0 0 0 0 15 16 1 0 0 0 0 15 32 1 0 0 0 0 16 33 1 0 0 0 0 17 20 1 0 0 0 0 17 34 1 0 0 0 0 17 35 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 19 37 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 21 23 1 0 0 0 0 21 38 1 0 0 0 0 22 24 2 0 0 0 0 22 39 1 0 0 0 0 23 25 2 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 25 42 1 0 0 0 0 M END $$$$