B6M9RJ -OEChem-04022103253D 53 55 0 0 0 0 0 0 0999 V2000 -4.1936 -2.0419 1.1527 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.0302 -2.4546 1.9263 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5148 -2.1029 1.7621 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0712 4.5206 -1.0678 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5606 -0.7339 -0.5055 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7292 -0.0150 1.6749 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2237 -2.9288 -0.3071 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0967 3.4113 -0.7135 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4835 0.6456 0.2905 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4408 1.3984 -0.0097 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9414 -0.4058 0.5918 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5596 2.1835 -0.2965 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6367 0.0786 0.4432 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0535 -2.9174 -1.1966 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2921 2.1973 -0.2693 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0392 0.4005 0.2977 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8696 1.7128 -0.1528 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7278 3.4292 -0.7004 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5258 -4.3379 -1.3349 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4563 -2.3326 -2.5426 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0884 1.8293 -0.1232 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8683 0.4252 0.3835 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5414 0.7102 1.5716 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5695 -0.0783 -0.7121 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6173 -0.0121 0.5683 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9158 0.4916 1.6639 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9440 -0.2968 -0.6196 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0505 -0.2393 0.6639 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9669 -0.9999 -0.5363 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3373 -1.5368 -1.9024 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7843 -0.5488 0.6807 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2436 -2.3161 -0.7777 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1153 -3.2634 -0.6915 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0535 0.0238 0.4045 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7247 2.3393 -0.3833 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6845 4.1857 -0.9891 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2347 -4.7411 -0.3587 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6482 -4.3674 -1.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2855 -5.0071 -1.7541 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6023 -2.3074 -3.2274 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8290 -1.3090 -2.4309 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2509 -2.9225 -3.0132 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8398 2.5999 -0.3792 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7225 5.2014 -1.3119 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0032 1.1024 2.4306 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0528 -0.3037 -1.6415 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4211 0.7203 2.5986 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4483 -0.6899 -1.4979 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5166 -0.0729 -0.3397 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2139 -1.7395 0.2333 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7800 -2.4540 -2.1199 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0778 -0.8146 -2.6835 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4080 -1.7515 -1.9612 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 3 2 0 0 0 0 1 7 1 0 0 0 0 1 11 1 0 0 0 0 4 18 1 0 0 0 0 4 44 1 0 0 0 0 5 28 1 0 0 0 0 5 29 1 0 0 0 0 6 28 2 0 0 0 0 7 14 1 0 0 0 0 7 33 1 0 0 0 0 8 12 1 0 0 0 0 8 18 1 0 0 0 0 8 36 1 0 0 0 0 9 21 2 0 0 0 0 9 22 1 0 0 0 0 10 12 2 0 0 0 0 10 13 1 0 0 0 0 10 15 1 0 0 0 0 11 13 2 0 0 0 0 11 16 1 0 0 0 0 12 17 1 0 0 0 0 13 31 1 0 0 0 0 14 19 1 0 0 0 0 14 20 1 0 0 0 0 14 32 1 0 0 0 0 15 18 2 0 0 0 0 15 21 1 0 0 0 0 16 17 2 0 0 0 0 16 34 1 0 0 0 0 17 35 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 21 43 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 23 26 1 0 0 0 0 23 45 1 0 0 0 0 24 27 2 0 0 0 0 24 46 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 25 28 1 0 0 0 0 26 47 1 0 0 0 0 27 48 1 0 0 0 0 29 30 1 0 0 0 0 29 49 1 0 0 0 0 29 50 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 30 53 1 0 0 0 0 M END $$$$