L6KS9V -OEChem-05032300403D 45 48 0 0 0 0 0 0 0999 V2000 2.5557 1.1339 -2.1537 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.5939 2.0485 -1.1773 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.1867 -3.6994 1.1194 S 0 0 0 0 0 0 0 0 0 0 0 0 4.7349 2.0419 3.2656 F 0 0 0 0 0 0 0 0 0 0 0 0 1.3444 -1.4071 -2.0193 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3761 0.5553 -1.3051 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3289 -1.7449 -0.4028 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8680 0.9784 0.9776 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7771 -3.8801 -0.5519 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8213 1.6273 1.3988 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3600 1.1054 2.5579 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8103 1.3991 -1.8774 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0527 0.3804 -1.5192 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8482 1.8127 -1.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2932 2.6779 -2.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0634 2.8975 -1.8151 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3947 -0.9949 -1.3371 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2126 1.4076 -0.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7454 1.5236 0.5237 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1238 -3.0856 -0.0622 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3314 0.3414 0.3717 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6080 2.6879 -0.1327 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6315 -5.1115 0.0565 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1173 0.6950 0.3134 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5869 0.7222 2.2853 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8456 0.5558 1.6506 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1222 2.9022 1.1461 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3792 -5.2069 0.9899 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2409 1.8361 2.0377 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5493 -6.1995 -0.3345 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9254 3.5163 -2.3075 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4746 3.8952 -1.9299 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0931 -1.2934 0.0938 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0370 -0.6660 0.0906 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5235 3.5314 -0.8135 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5362 1.6336 -0.0578 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9259 0.0008 -0.5087 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8118 0.2392 1.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2858 0.2700 2.9748 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9396 -0.2743 2.3445 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4302 3.8988 1.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6755 -6.0597 1.5843 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5730 -6.9951 0.4172 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2336 -6.6371 -1.2867 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5691 -5.8198 -0.4528 H 0 0 0 0 0 0 0 0 0 0 0 0 1 12 1 0 0 0 0 1 18 1 0 0 0 0 2 14 1 0 0 0 0 2 19 1 0 0 0 0 3 20 1 0 0 0 0 3 28 1 0 0 0 0 4 29 1 0 0 0 0 5 17 2 0 0 0 0 6 13 1 0 0 0 0 6 14 2 0 0 0 0 7 17 1 0 0 0 0 7 20 1 0 0 0 0 7 33 1 0 0 0 0 8 19 1 0 0 0 0 8 24 1 0 0 0 0 8 25 1 0 0 0 0 9 20 2 0 0 0 0 9 23 1 0 0 0 0 10 11 1 0 0 0 0 10 19 2 0 0 0 0 11 25 2 0 0 0 0 12 13 2 0 0 0 0 12 15 1 0 0 0 0 13 17 1 0 0 0 0 14 16 1 0 0 0 0 15 16 2 0 0 0 0 15 31 1 0 0 0 0 16 32 1 0 0 0 0 18 21 2 0 0 0 0 18 22 1 0 0 0 0 21 26 1 0 0 0 0 21 34 1 0 0 0 0 22 27 2 0 0 0 0 22 35 1 0 0 0 0 23 28 2 0 0 0 0 23 30 1 0 0 0 0 24 36 1 0 0 0 0 24 37 1 0 0 0 0 24 38 1 0 0 0 0 25 39 1 0 0 0 0 26 29 2 0 0 0 0 26 40 1 0 0 0 0 27 29 1 0 0 0 0 27 41 1 0 0 0 0 28 42 1 0 0 0 0 30 43 1 0 0 0 0 30 44 1 0 0 0 0 30 45 1 0 0 0 0 M END $$$$