J90 Converted by convert_cif2sdf.py 2024/03/29 11:09:15 33 34 0 0 0 0 0 0 0 0999 V2000 -5.5198 -1.0660 -0.0153 N 0 0 0 0 0 -4.6339 -2.0821 0.0130 C 0 0 0 0 0 -3.3468 -1.8703 -0.0028 N 0 0 0 0 0 -2.8455 -0.6260 -0.0486 C 0 0 0 0 0 -3.7085 0.4567 -0.0796 C 0 0 0 0 0 -5.0880 0.2113 -0.0617 C 0 0 0 0 0 -1.4806 -0.4273 -0.0643 N 0 0 0 0 0 0.8537 -1.0836 0.0359 C 0 0 0 0 0 1.4997 -0.7104 1.1997 C 0 0 0 0 0 2.8098 -0.2726 1.1532 C 0 0 0 0 0 3.4750 -0.2081 -0.0571 C 0 0 0 0 0 2.8290 -0.5823 -1.2209 C 0 0 0 0 0 1.5189 -1.0191 -1.1744 C 0 0 0 0 0 5.1448 0.3514 -0.1169 S 0 0 0 0 0 5.3604 0.8285 -1.4380 O 0 0 0 0 0 5.3407 1.1519 1.0398 O 0 0 0 0 0 6.1139 -0.9782 0.0649 N 0 0 0 0 0 -3.1852 1.8408 -0.1299 N 0 3 0 0 0 -1.9887 2.0362 -0.2490 O 0 5 0 0 0 -3.9508 2.7847 -0.0528 O 0 0 0 0 0 -5.8842 1.1361 -0.0879 O 0 0 0 0 0 -0.5720 -1.5676 0.0870 C 0 0 0 0 0 -6.4705 -1.2546 -0.0063 H 0 0 0 0 0 -5.0001 -3.0975 0.0506 H 0 0 0 0 0 -1.1214 0.4663 -0.1759 H 0 0 0 0 0 0.9809 -0.7605 2.1451 H 0 0 0 0 0 3.3148 0.0202 2.0624 H 0 0 0 0 0 3.3478 -0.5312 -2.1673 H 0 0 0 0 0 1.0139 -1.3109 -2.0836 H 0 0 0 0 0 6.9913 -0.9997 -0.3487 H 0 0 0 0 0 5.8048 -1.7372 0.5851 H 0 0 0 0 0 -0.7569 -2.0533 1.0450 H 0 0 0 0 0 -0.7446 -2.2787 -0.7199 H 0 0 0 0 0 1 2 1 0 0 0 1 6 1 0 0 0 2 3 2 0 0 0 3 4 1 0 0 0 4 5 2 0 0 0 4 7 1 0 0 0 5 6 1 0 0 0 5 18 1 0 0 0 6 21 2 0 0 0 7 22 1 0 0 0 8 9 2 0 0 0 8 13 1 0 0 0 8 22 1 0 0 0 9 10 1 0 0 0 10 11 2 0 0 0 11 12 1 0 0 0 11 14 1 0 0 0 12 13 2 0 0 0 14 15 2 0 0 0 14 16 2 0 0 0 14 17 1 0 0 0 18 19 1 0 0 0 18 20 2 0 0 0 1 23 1 0 0 0 2 24 1 0 0 0 7 25 1 0 0 0 9 26 1 0 0 0 10 27 1 0 0 0 12 28 1 0 0 0 13 29 1 0 0 0 17 30 1 0 0 0 17 31 1 0 0 0 22 32 1 0 0 0 22 33 1 0 0 0 M END $$$$