B1DKX4 -OEChem-04022113223D 52 53 0 1 0 0 0 0 0999 V2000 4.5929 -0.5525 0.1718 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2873 0.4705 -0.3971 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5164 0.4444 -2.6050 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4937 -1.1342 0.8997 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6074 -1.9194 -0.6705 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8721 0.8086 -0.3115 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2473 -0.2921 -2.4998 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5236 -0.4784 -2.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5161 1.2992 -0.3502 C 0 0 1 0 0 0 0 0 0 0 0 0 1.4626 2.8254 -0.4516 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1231 -1.7398 0.7716 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1422 3.5085 0.7377 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8754 0.6612 -1.5774 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4434 -2.9514 0.1353 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6256 -1.7615 0.4988 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8506 -1.6890 2.2744 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2462 -0.3657 0.3098 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1317 5.0219 0.5892 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5607 0.2643 -1.5295 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5005 -0.0193 -0.7727 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5375 0.0428 0.2158 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5603 -0.9053 0.2402 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5155 1.0695 1.1597 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5610 -0.8269 1.2087 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5164 1.1480 2.1282 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5391 0.1999 2.1528 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9354 -3.1288 -0.3265 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0029 0.9536 0.5539 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4170 3.1520 -0.5155 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9465 3.1524 -1.3816 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6290 3.2312 1.6658 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1825 3.1776 0.8309 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5891 1.3250 -0.8127 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4294 -3.1450 0.4938 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3865 -2.8427 -0.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0105 -3.8648 0.3517 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1082 -0.8684 0.9121 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8246 -1.7500 -0.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1060 -2.6457 0.9302 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0935 -0.7012 2.6832 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8182 -1.9086 2.5576 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4651 -2.4298 2.7996 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6702 5.3317 -0.3122 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1072 5.4024 0.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6154 5.4907 1.4518 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7362 1.8279 1.1608 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3617 -1.5612 1.2338 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5007 1.9485 2.8621 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3187 0.2615 2.9065 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0136 -3.8163 -1.1731 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4091 -3.5925 0.5446 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8757 -2.9460 -0.1225 H 0 0 0 0 0 0 0 0 0 0 0 0 1 11 1 0 0 0 0 1 17 1 0 0 0 0 2 19 1 0 0 0 0 2 20 1 0 0 0 0 3 13 2 0 0 0 0 4 17 2 0 0 0 0 5 22 1 0 0 0 0 5 27 1 0 0 0 0 6 9 1 0 0 0 0 6 17 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 19 2 0 0 0 0 8 20 2 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 9 28 1 0 0 0 0 10 12 1 0 0 0 0 10 29 1 0 0 0 0 10 30 1 0 0 0 0 11 14 1 0 0 0 0 11 15 1 0 0 0 0 11 16 1 0 0 0 0 12 18 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 13 19 1 0 0 0 0 14 34 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 15 39 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 18 43 1 0 0 0 0 18 44 1 0 0 0 0 18 45 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 23 2 0 0 0 0 22 24 2 0 0 0 0 23 25 1 0 0 0 0 23 46 1 0 0 0 0 24 26 1 0 0 0 0 24 47 1 0 0 0 0 25 26 2 0 0 0 0 25 48 1 0 0 0 0 26 49 1 0 0 0 0 27 50 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 M END $$$$