JQA Converted by convert_cif2sdf.py 2024/03/29 11:09:15 40 43 0 0 0 0 0 0 0 0999 V2000 -3.5793 0.2687 0.9454 N 0 0 0 0 0 -2.7223 1.3252 0.4550 C 0 0 0 0 0 -2.5012 1.5701 -1.0118 C 0 0 0 0 0 -0.9783 1.5879 -1.3807 C 0 0 0 0 0 -0.4501 0.2818 -0.9724 C 0 0 0 0 0 -0.7271 0.0401 0.5371 C 0 0 0 0 0 1.9480 -0.2728 -1.7209 C 0 0 0 0 0 4.5438 -0.1976 1.0195 C 0 0 0 0 0 3.7704 2.0372 0.6448 C 0 0 0 0 0 1.1603 -2.7203 -0.5247 O 0 0 0 0 0 0.3056 -1.8628 -0.6157 C 0 0 0 0 0 -0.9745 -2.1459 -0.2151 O 0 0 0 0 0 -1.7939 -1.0492 0.2000 C 0 0 0 0 0 -2.8085 -0.9755 1.3207 C 0 0 0 0 0 -1.3771 1.2497 1.1753 C 0 0 0 0 0 0.6634 -0.6109 -1.1284 N 0 0 0 0 0 2.8798 0.2298 -0.6485 C 0 0 0 0 0 3.6890 -0.6585 0.0347 C 0 0 0 0 0 4.5845 1.1498 1.3240 C 0 0 0 0 0 2.9156 1.5762 -0.3390 C 0 0 0 0 0 -4.1307 0.5910 1.7267 H 0 0 0 0 0 -3.1707 2.2427 0.8297 H 0 0 0 0 0 -3.0025 0.7927 -1.5897 H 0 0 0 0 0 -2.9391 2.5359 -1.2776 H 0 0 0 0 0 -0.8614 1.7258 -2.4590 H 0 0 0 0 0 -0.4697 2.3961 -0.8548 H 0 0 0 0 0 -1.1953 -0.3737 -1.4063 H 0 0 0 0 0 0.1378 -0.3212 1.1114 H 0 0 0 0 0 2.3775 -1.1590 -2.1896 H 0 0 0 0 0 1.8082 0.5038 -2.4731 H 0 0 0 0 0 5.1771 -0.8914 1.5524 H 0 0 0 0 0 3.8012 3.0897 0.8836 H 0 0 0 0 0 -2.4044 -0.7446 -0.6529 H 0 0 0 0 0 -2.3151 -0.8523 2.2783 H 0 0 0 0 0 -3.4552 -1.8467 1.3061 H 0 0 0 0 0 -0.7908 2.1460 0.9983 H 0 0 0 0 0 -1.5232 1.0862 2.2419 H 0 0 0 0 0 3.6543 -1.7117 -0.2002 H 0 0 0 0 0 5.2525 1.5103 2.0919 H 0 0 0 0 0 2.2793 2.2695 -0.8699 H 0 0 0 0 0 3 4 1 0 0 0 3 2 1 0 0 0 4 5 1 0 0 0 2 1 1 0 0 0 2 15 1 0 0 0 20 9 2 0 0 0 20 17 1 0 0 0 9 19 1 0 0 0 5 16 1 0 0 0 5 6 1 0 0 0 1 14 1 0 0 0 15 6 1 0 0 0 7 17 1 0 0 0 7 16 1 0 0 0 17 18 2 0 0 0 19 8 2 0 0 0 16 11 1 0 0 0 6 13 1 0 0 0 8 18 1 0 0 0 13 14 1 0 0 0 13 12 1 0 0 0 11 12 1 0 0 0 11 10 2 0 0 0 1 21 1 0 0 0 2 22 1 0 0 0 3 23 1 0 0 0 3 24 1 0 0 0 4 25 1 0 0 0 4 26 1 0 0 0 5 27 1 0 0 0 6 28 1 0 0 0 7 29 1 0 0 0 7 30 1 0 0 0 8 31 1 0 0 0 9 32 1 0 0 0 13 33 1 0 0 0 14 34 1 0 0 0 14 35 1 0 0 0 15 36 1 0 0 0 15 37 1 0 0 0 18 38 1 0 0 0 19 39 1 0 0 0 20 40 1 0 0 0 M END $$$$