JA1 Converted by convert_cif2sdf.py 2024/03/29 11:09:15 44 45 0 0 0 0 0 0 0 0999 V2000 -2.8047 -2.1988 0.8004 C 0 0 0 0 0 -8.7582 2.6076 -0.3483 N 0 3 0 0 0 -3.1260 -3.2564 1.5913 O 0 0 0 0 0 -3.7636 -1.2360 0.4990 C 0 0 0 0 0 -5.0240 -1.3510 0.9960 O 0 0 0 0 0 -5.9288 -0.3914 0.6701 C 0 0 0 0 0 -9.4475 2.4809 -1.3437 O 0 0 0 0 0 -6.7157 -0.5345 -0.4642 C 0 0 0 0 0 -8.8794 3.5952 0.3554 O 0 5 0 0 0 -7.6356 0.4426 -0.7930 C 0 0 0 0 0 -7.7717 1.5621 0.0066 C 0 0 0 0 0 -6.9884 1.7079 1.1365 C 0 0 0 0 0 -6.0716 0.7305 1.4734 C 0 0 0 0 0 -3.4310 -0.1589 -0.3077 C 0 0 0 0 0 -2.1494 -0.0433 -0.8111 C 0 0 0 0 0 -1.1969 -0.9999 -0.5128 C 0 0 0 0 0 0.1995 -0.8680 -1.0644 C 0 0 0 0 0 1.0619 -0.0700 -0.0849 C 0 0 0 0 0 2.4797 0.0641 -0.6453 C 0 0 0 0 0 3.3420 0.8610 0.3344 C 0 0 0 0 0 4.7598 0.9951 -0.2260 C 0 0 0 0 0 5.6222 1.7931 0.7535 C 0 0 0 0 0 -1.5200 -2.0735 0.2962 C 0 0 0 0 0 -3.4583 -4.0245 1.1056 H 0 0 0 0 0 -6.6094 -1.4084 -1.0890 H 0 0 0 0 0 -8.2482 0.3322 -1.6756 H 0 0 0 0 0 -7.0966 2.5837 1.7589 H 0 0 0 0 0 -5.4640 0.8420 2.3590 H 0 0 0 0 0 -4.1739 0.5890 -0.5421 H 0 0 0 0 0 -1.8917 0.7967 -1.4394 H 0 0 0 0 0 0.6302 -1.8597 -1.2032 H 0 0 0 0 0 0.1633 -0.3491 -2.0233 H 0 0 0 0 0 0.6312 0.9217 0.0540 H 0 0 0 0 0 1.0972 -0.5880 0.8729 H 0 0 0 0 0 2.9104 -0.9276 -0.7841 H 0 0 0 0 0 2.4444 0.5820 -1.6030 H 0 0 0 0 0 2.9113 1.8527 0.4733 H 0 0 0 0 0 3.3783 0.3430 1.2922 H 0 0 0 0 0 5.1905 0.0034 -0.3648 H 0 0 0 0 0 4.7245 1.5131 -1.1837 H 0 0 0 0 0 5.1915 2.7850 0.8934 H 0 0 0 0 0 5.6584 1.2742 1.7124 H 0 0 0 0 0 6.6322 1.8884 0.3550 H 0 0 0 0 0 -0.7739 -2.8193 0.5272 H 0 0 0 0 0 4 1 2 0 0 0 23 1 1 0 0 0 1 3 1 0 0 0 11 2 1 0 0 0 2 7 2 0 0 0 2 9 1 0 0 0 3 24 1 0 0 0 14 4 1 0 0 0 4 5 1 0 0 0 5 6 1 0 0 0 6 13 2 0 0 0 6 8 1 0 0 0 8 10 2 0 0 0 8 25 1 0 0 0 10 11 1 0 0 0 10 26 1 0 0 0 12 11 2 0 0 0 13 12 1 0 0 0 12 27 1 0 0 0 13 28 1 0 0 0 15 14 2 0 0 0 14 29 1 0 0 0 15 16 1 0 0 0 15 30 1 0 0 0 17 16 1 0 0 0 16 23 2 0 0 0 17 18 1 0 0 0 17 31 1 0 0 0 17 32 1 0 0 0 19 18 1 0 0 0 18 33 1 0 0 0 18 34 1 0 0 0 19 20 1 0 0 0 19 35 1 0 0 0 19 36 1 0 0 0 20 21 1 0 0 0 20 37 1 0 0 0 20 38 1 0 0 0 21 22 1 0 0 0 21 39 1 0 0 0 21 40 1 0 0 0 22 41 1 0 0 0 22 42 1 0 0 0 22 43 1 0 0 0 23 44 1 0 0 0 M END $$$$