91E Converted by convert_cif2sdf.py 2024/03/29 11:09:15 58 60 0 0 0 0 0 0 0 0999 V2000 6.6975 0.4324 1.7944 C 0 0 0 0 0 6.9342 -0.4327 0.5827 C 0 0 0 0 0 8.1014 -1.1638 0.4739 C 0 0 0 0 0 8.3207 -1.9580 -0.6360 C 0 0 0 0 0 7.3736 -2.0226 -1.6414 C 0 0 0 0 0 6.2041 -1.2938 -1.5397 C 0 0 0 0 0 5.0154 -1.3757 -2.8013 CL 0 0 0 0 0 5.9781 -0.5001 -0.4215 C 0 0 0 0 0 4.7952 0.2400 -0.3142 N 0 0 0 0 0 3.6180 -0.3181 -0.6597 C 0 0 0 0 0 3.5751 -1.4849 -1.0048 O 0 0 0 0 0 2.3925 0.4785 -0.6209 C 0 0 0 0 0 2.2689 2.1717 -0.1498 S 0 0 0 0 0 1.1384 0.0432 -0.9488 C 0 0 0 0 0 0.2092 0.9568 -0.8285 N 0 0 0 0 0 0.5820 2.1375 -0.4240 C 0 0 0 0 0 -0.2662 3.2105 -0.2429 N 0 0 0 0 0 -1.6470 3.0382 -0.3674 C 0 0 0 0 0 -2.2163 1.7971 -0.1254 C 0 0 0 0 0 -2.4520 4.1134 -0.7296 C 0 0 0 0 0 -3.8185 3.9485 -0.8540 C 0 0 0 0 0 -4.3938 2.7156 -0.6210 C 0 0 0 0 0 -3.5950 1.6310 -0.2524 C 0 0 0 0 0 -4.2101 0.3113 0.0053 C 0 0 0 0 0 -3.5133 -0.6313 0.3268 O 0 0 0 0 0 -5.5432 0.1527 -0.1179 N 0 0 0 0 0 -6.1520 -1.1550 0.1366 C 0 0 0 0 0 -7.6650 -1.0619 -0.0714 C 0 0 0 0 0 -8.2498 -0.0300 0.8954 C 0 0 0 0 0 -7.9572 -0.6351 -1.5116 C 0 0 0 0 0 -8.3009 -2.4276 0.1938 C 0 0 0 0 0 -9.7536 -2.3393 -0.0051 N 0 0 0 0 0 7.0913 1.4325 1.6094 H 0 0 0 0 0 5.6269 0.4943 1.9919 H 0 0 0 0 0 7.2013 -0.0033 2.6564 H 0 0 0 0 0 8.8435 -1.1152 1.2568 H 0 0 0 0 0 9.2336 -2.5284 -0.7187 H 0 0 0 0 0 7.5483 -2.6437 -2.5083 H 0 0 0 0 0 4.8230 1.1541 0.0099 H 0 0 0 0 0 0.9329 -0.9643 -1.2786 H 0 0 0 0 0 0.0966 4.0842 -0.0284 H 0 0 0 0 0 -1.5945 0.9620 0.1589 H 0 0 0 0 0 -2.0075 5.0798 -0.9128 H 0 0 0 0 0 -4.4380 4.7871 -1.1340 H 0 0 0 0 0 -5.4618 2.5912 -0.7194 H 0 0 0 0 0 -6.0993 0.9056 -0.3743 H 0 0 0 0 0 -5.7350 -1.8895 -0.5525 H 0 0 0 0 0 -5.9437 -1.4596 1.1624 H 0 0 0 0 0 -7.7973 0.9425 0.7064 H 0 0 0 0 0 -9.3275 0.0355 0.7477 H 0 0 0 0 0 -8.0416 -0.3346 1.9211 H 0 0 0 0 0 -7.5403 -1.3696 -2.1998 H 0 0 0 0 0 -9.0349 -0.5685 -1.6592 H 0 0 0 0 0 -7.5036 0.3384 -1.7005 H 0 0 0 0 0 -7.8840 -3.1631 -0.4944 H 0 0 0 0 0 -8.0927 -2.7322 1.2195 H 0 0 0 0 0 -10.1973 -3.2290 0.1641 H 0 0 0 0 0 -10.1549 -1.6189 0.5766 H 0 0 0 0 0 25 24 2 0 0 0 31 32 1 0 0 0 31 28 1 0 0 0 27 28 1 0 0 0 27 26 1 0 0 0 28 30 1 0 0 0 28 29 1 0 0 0 24 26 1 0 0 0 24 23 1 0 0 0 19 23 2 0 0 0 19 18 1 0 0 0 23 22 1 0 0 0 17 18 1 0 0 0 17 16 1 0 0 0 18 20 2 0 0 0 15 16 2 0 0 0 15 14 1 0 0 0 16 13 1 0 0 0 22 21 2 0 0 0 14 12 2 0 0 0 20 21 1 0 0 0 13 12 1 0 0 0 12 10 1 0 0 0 9 10 1 0 0 0 9 8 1 0 0 0 10 11 2 0 0 0 7 6 1 0 0 0 8 6 2 0 0 0 8 2 1 0 0 0 6 5 1 0 0 0 1 2 1 0 0 0 2 3 2 0 0 0 5 4 2 0 0 0 3 4 1 0 0 0 1 33 1 0 0 0 1 34 1 0 0 0 1 35 1 0 0 0 3 36 1 0 0 0 4 37 1 0 0 0 5 38 1 0 0 0 9 39 1 0 0 0 14 40 1 0 0 0 17 41 1 0 0 0 19 42 1 0 0 0 20 43 1 0 0 0 21 44 1 0 0 0 22 45 1 0 0 0 26 46 1 0 0 0 27 47 1 0 0 0 27 48 1 0 0 0 29 49 1 0 0 0 29 50 1 0 0 0 29 51 1 0 0 0 30 52 1 0 0 0 30 53 1 0 0 0 30 54 1 0 0 0 31 55 1 0 0 0 31 56 1 0 0 0 32 57 1 0 0 0 32 58 1 0 0 0 M END $$$$