BKS3Q7 -OEChem-04042104343D 38 41 0 0 0 0 0 0 0999 V2000 4.6831 -1.9009 0.4679 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3611 2.3995 1.3697 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1671 2.6199 -0.0439 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2483 0.1052 -0.1723 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2603 1.3765 -0.1053 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4076 0.3745 0.2048 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8821 -2.9383 -0.5009 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3672 -1.1928 -0.1012 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6554 0.2127 -0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4309 -2.3346 0.1169 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4872 -1.0155 0.1634 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5100 1.3113 -0.3231 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8828 -2.2057 0.2497 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7529 -1.3804 -0.2711 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1530 -3.6087 0.1917 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4568 1.6652 0.6381 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3016 2.1316 -1.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9563 -0.9290 0.2963 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1953 2.8393 0.4907 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3262 -2.6524 -0.1971 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5280 -3.7649 0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0399 3.3061 -1.5793 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9868 3.6598 -0.6182 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6255 1.5142 0.0141 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2072 3.2176 1.5189 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7367 -2.8102 -0.3647 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4486 -3.1182 0.4121 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4088 -0.5402 -0.4846 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4588 -4.4915 0.3637 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6136 1.0383 1.5132 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4215 1.8642 -2.1984 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9590 -4.7612 0.0994 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8801 3.9429 -2.4445 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5564 4.5763 -0.7472 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4102 0.5188 0.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5085 4.2661 1.4211 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8001 3.0799 2.5267 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9909 2.6666 2.0607 H 0 0 0 0 0 0 0 0 0 0 0 0 1 18 2 0 0 0 0 2 25 1 0 0 0 0 2 38 1 0 0 0 0 3 24 2 0 0 0 0 4 8 1 0 0 0 0 4 9 1 0 0 0 0 4 12 1 0 0 0 0 5 9 2 0 0 0 0 5 24 1 0 0 0 0 6 18 1 0 0 0 0 6 24 1 0 0 0 0 6 35 1 0 0 0 0 7 26 3 0 0 0 0 8 10 2 0 0 0 0 8 14 1 0 0 0 0 9 11 1 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 18 1 0 0 0 0 12 16 1 0 0 0 0 12 17 2 0 0 0 0 13 27 1 0 0 0 0 14 20 2 0 0 0 0 14 28 1 0 0 0 0 15 21 2 0 0 0 0 15 29 1 0 0 0 0 16 19 2 0 0 0 0 16 30 1 0 0 0 0 17 22 1 0 0 0 0 17 31 1 0 0 0 0 19 23 1 0 0 0 0 19 25 1 0 0 0 0 20 21 1 0 0 0 0 20 26 1 0 0 0 0 21 32 1 0 0 0 0 22 23 2 0 0 0 0 22 33 1 0 0 0 0 23 34 1 0 0 0 0 25 36 1 0 0 0 0 25 37 1 0 0 0 0 M END $$$$