BDQY18 -OEChem-04022104163D 56 58 0 0 0 0 0 0 0999 V2000 -9.4043 -1.7533 -0.3259 S 0 0 0 0 0 0 0 0 0 0 0 0 10.1910 -0.3605 -0.0423 F 0 0 0 0 0 0 0 0 0 0 0 0 9.5481 -2.0697 1.1379 F 0 0 0 0 0 0 0 0 0 0 0 0 9.5707 -2.1973 -1.0270 F 0 0 0 0 0 0 0 0 0 0 0 0 -2.8567 0.0085 0.7822 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.3302 -1.0741 -1.2214 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.0049 -3.1258 -0.6044 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3133 1.7314 -0.0508 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9333 0.5992 -0.1669 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3260 2.2459 0.5363 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4985 1.5750 0.1814 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.0186 -1.6733 1.2664 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1530 1.9213 -1.2397 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5807 0.4163 0.5445 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6394 1.8452 -0.8817 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0474 0.2909 0.9627 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1019 1.8599 -0.3963 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2461 0.1171 -0.1236 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9290 2.1259 0.8529 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3184 1.0083 -0.1644 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4825 -1.2551 -0.0403 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6270 0.5274 -0.1218 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7910 -1.7360 0.0022 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8633 -0.8448 -0.0384 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2094 1.1566 0.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2623 -1.3595 0.0067 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6645 0.7836 0.0602 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8763 1.3768 -0.2941 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6029 -0.5900 0.2956 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9647 -0.7768 -0.1772 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0264 0.5967 -0.4128 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7531 -1.3701 0.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9186 1.1668 -2.0029 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9624 2.9058 -1.6843 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9766 0.2511 1.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3352 -0.3870 -0.1637 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2160 1.9038 -1.8134 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9113 2.7067 -0.2583 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2647 0.9798 1.7894 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2082 -0.7257 1.3396 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2490 2.7138 -1.0718 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4698 0.9778 -0.9371 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8244 1.3330 1.5988 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6243 3.0681 1.3223 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1716 2.0834 -0.2149 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6610 -1.9666 -0.0222 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6865 3.1652 0.3003 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4483 1.2380 -0.1515 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9655 -2.8069 0.0638 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6218 2.5671 -0.0045 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9381 2.4462 -0.4788 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7037 -1.1205 0.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9606 1.0807 -0.6833 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6848 -2.4369 0.3712 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8707 -1.1207 1.4215 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9634 -2.5224 1.8419 H 0 0 0 0 0 0 0 0 0 0 0 0 1 6 2 0 0 0 0 1 7 2 0 0 0 0 1 12 1 0 0 0 0 1 30 1 0 0 0 0 2 26 1 0 0 0 0 3 26 1 0 0 0 0 4 26 1 0 0 0 0 5 25 2 0 0 0 0 8 13 1 0 0 0 0 8 14 1 0 0 0 0 8 17 1 0 0 0 0 9 15 1 0 0 0 0 9 16 1 0 0 0 0 9 18 1 0 0 0 0 10 19 1 0 0 0 0 10 25 1 0 0 0 0 10 47 1 0 0 0 0 11 25 1 0 0 0 0 11 27 1 0 0 0 0 11 50 1 0 0 0 0 12 55 1 0 0 0 0 12 56 1 0 0 0 0 13 15 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 14 16 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 17 19 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 18 20 2 0 0 0 0 18 21 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 20 22 1 0 0 0 0 20 45 1 0 0 0 0 21 23 2 0 0 0 0 21 46 1 0 0 0 0 22 24 2 0 0 0 0 22 48 1 0 0 0 0 23 24 1 0 0 0 0 23 49 1 0 0 0 0 24 26 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 28 31 1 0 0 0 0 28 51 1 0 0 0 0 29 32 2 0 0 0 0 29 52 1 0 0 0 0 30 31 2 0 0 0 0 30 32 1 0 0 0 0 31 53 1 0 0 0 0 32 54 1 0 0 0 0 M END $$$$