B91HFT -OEChem-04012112193D 61 65 0 0 0 0 0 0 0999 V2000 -2.4551 1.1210 0.2586 N 0 3 0 0 0 0 0 0 0 0 0 0 1.0517 -1.2040 0.3922 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9232 -3.9122 -0.0443 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.1633 1.8515 -0.2902 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9304 -1.8769 -0.1900 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7734 1.7782 -1.1548 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8229 1.6279 -2.4332 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3449 0.3806 0.3002 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3939 -0.9901 0.0814 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6744 0.6151 0.0091 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6423 -1.5969 -0.1877 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8161 -0.7734 -0.2252 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3305 2.5790 0.5013 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2163 -1.7541 0.1289 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1503 1.1557 0.5876 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7803 1.4785 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6396 -2.9968 -0.4038 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1284 -1.2401 -0.4816 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2514 -3.1282 -0.0883 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0537 0.9824 -0.2686 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4631 -3.7497 -0.3549 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0916 3.2910 -0.8152 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2280 -0.3758 -0.5027 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5843 1.7075 -0.4582 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2524 1.3426 1.9070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7312 2.4519 -0.1824 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3992 2.0873 2.1826 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1386 2.6419 1.1379 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1971 -1.3277 0.0725 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7158 -0.3509 -0.7721 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9237 -1.7647 1.1759 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9729 0.1941 -0.5107 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1808 -1.2197 1.4375 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7054 -0.2404 0.5942 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5204 1.2151 -1.3899 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1836 2.9747 1.0562 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5430 2.8251 1.2116 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7286 2.5517 0.1171 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5612 -3.5329 -0.6163 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3219 -2.2927 -0.6714 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5142 -4.8219 -0.5278 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5977 2.6828 -1.5742 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5117 4.2059 -0.6564 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0480 3.5970 -1.2535 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2163 -0.7818 -0.7042 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3043 1.5424 -1.4953 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3125 0.9154 2.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3105 2.8782 -0.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7176 2.2339 3.2105 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7479 -3.5655 0.4228 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8497 -4.9089 -0.2056 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0881 1.4866 -0.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0376 2.8401 -0.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0335 3.2187 1.3521 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1293 -0.0355 -1.6314 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5232 -2.5267 1.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7502 -1.5582 2.2982 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6860 0.1494 0.8436 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1372 2.4914 -1.7784 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3713 1.5217 -0.3793 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3702 2.3439 -2.9238 H 0 0 0 0 0 0 0 0 0 0 0 0 1 8 1 0 0 0 0 1 10 2 0 0 0 0 1 13 1 0 0 0 0 2 5 2 0 0 0 0 2 14 1 0 0 0 0 3 19 1 0 0 0 0 3 50 1 0 0 0 0 3 51 1 0 0 0 0 4 20 1 0 0 0 0 4 52 1 0 0 0 0 4 53 1 0 0 0 0 5 29 1 0 0 0 0 6 35 1 0 0 0 0 6 59 1 0 0 0 0 6 60 1 0 0 0 0 7 35 2 0 0 0 0 7 61 1 0 0 0 0 8 9 2 0 0 0 0 8 15 1 0 0 0 0 9 11 1 0 0 0 0 9 14 1 0 0 0 0 10 12 1 0 0 0 0 10 16 1 0 0 0 0 11 12 2 0 0 0 0 11 17 1 0 0 0 0 12 18 1 0 0 0 0 13 22 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 19 2 0 0 0 0 15 24 2 0 0 0 0 15 25 1 0 0 0 0 16 20 2 0 0 0 0 16 38 1 0 0 0 0 17 21 2 0 0 0 0 17 39 1 0 0 0 0 18 23 2 0 0 0 0 18 40 1 0 0 0 0 19 21 1 0 0 0 0 20 23 1 0 0 0 0 21 41 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 23 45 1 0 0 0 0 24 26 1 0 0 0 0 24 46 1 0 0 0 0 25 27 2 0 0 0 0 25 47 1 0 0 0 0 26 28 2 0 0 0 0 26 48 1 0 0 0 0 27 28 1 0 0 0 0 27 49 1 0 0 0 0 28 54 1 0 0 0 0 29 30 1 0 0 0 0 29 31 2 0 0 0 0 30 32 2 0 0 0 0 30 55 1 0 0 0 0 31 33 1 0 0 0 0 31 56 1 0 0 0 0 32 34 1 0 0 0 0 32 35 1 0 0 0 0 33 34 2 0 0 0 0 33 57 1 0 0 0 0 34 58 1 0 0 0 0 M CHG 1 1 1 M END $$$$