BL4KG2 -OEChem-04022117313D 39 41 0 0 0 0 0 0 0999 V2000 5.4671 1.1192 0.1354 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.8102 1.8141 -0.9718 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.7002 -0.5187 -0.1049 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3256 2.0912 1.2105 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6495 0.2710 0.0782 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5617 -1.1564 -0.0831 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6434 -2.3573 0.1005 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2445 -0.8653 -0.0348 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5788 -3.1233 0.0485 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2975 1.9248 -1.3619 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9759 -3.0663 -0.0376 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7880 -1.5333 0.1091 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0511 0.0980 0.1261 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2458 1.2984 -0.2003 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7020 -2.0813 0.0363 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9879 -1.9995 -0.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7197 -0.2514 0.6546 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1193 -1.1839 -0.4196 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8512 0.5643 0.6632 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9878 2.3489 0.2823 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5297 -0.1514 -0.1329 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7400 -2.5157 -0.0196 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3677 3.6034 0.0143 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2794 2.2123 0.9979 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1767 3.4579 -0.6623 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8978 -3.3415 0.0366 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0540 -2.9953 -0.8588 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8119 0.1353 1.1068 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0414 -1.5648 -0.8495 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7752 1.5592 1.0928 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7690 4.5675 0.3002 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6029 3.1682 1.4234 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0639 1.8699 0.3151 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1966 1.4975 1.8233 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5041 4.2382 -0.9896 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0477 2.9210 -1.3416 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9512 1.6755 -2.1142 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8272 -2.5173 -0.0968 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1054 -4.0720 0.0069 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 2 0 0 0 0 1 5 2 0 0 0 0 1 10 1 0 0 0 0 1 13 1 0 0 0 0 2 14 1 0 0 0 0 2 25 1 0 0 0 0 3 21 2 0 0 0 0 6 8 1 0 0 0 0 6 21 1 0 0 0 0 6 22 1 0 0 0 0 7 12 1 0 0 0 0 7 15 1 0 0 0 0 7 26 1 0 0 0 0 8 15 2 0 0 0 0 9 15 1 0 0 0 0 9 22 2 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 11 22 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 16 2 0 0 0 0 12 17 1 0 0 0 0 13 18 2 0 0 0 0 13 19 1 0 0 0 0 14 20 2 0 0 0 0 14 21 1 0 0 0 0 16 18 1 0 0 0 0 16 27 1 0 0 0 0 17 19 2 0 0 0 0 17 28 1 0 0 0 0 18 29 1 0 0 0 0 19 30 1 0 0 0 0 20 23 1 0 0 0 0 20 24 1 0 0 0 0 23 25 2 0 0 0 0 23 31 1 0 0 0 0 24 32 1 0 0 0 0 24 33 1 0 0 0 0 24 34 1 0 0 0 0 25 35 1 0 0 0 0 M END $$$$