JRD Converted by convert_cif2sdf.py 2024/03/01 05:07:52 40 42 0 0 0 0 0 0 0 0999 V2000 -2.1217 3.1417 0.7517 O 0 0 0 0 0 -1.2765 2.2727 0.7513 C 0 0 0 0 0 0.0859 2.5455 0.1661 C 0 0 0 0 0 0.1359 3.9811 -0.3605 C 0 0 0 0 0 -1.5522 1.0633 1.2790 N 0 0 0 0 0 -2.8744 0.7998 1.8535 C 0 0 0 0 0 -3.7894 0.2618 0.7825 C 0 0 0 0 0 -4.5801 0.9760 -0.0300 O 0 0 0 0 0 -5.1985 0.2644 -0.7868 N 0 0 0 0 0 -4.9192 -0.9930 -0.5977 C 0 0 0 0 0 -5.4904 -2.1675 -1.3500 C 0 0 0 0 0 -3.9686 -1.0381 0.4486 C 0 0 0 0 0 -0.5846 0.0666 1.2783 C 0 0 0 0 0 -0.7934 -1.5570 1.9269 S 0 0 0 0 0 0.8594 -1.9552 1.4663 C 0 0 0 0 0 1.4066 -0.8718 0.8856 C 0 0 0 0 0 0.6126 0.1861 0.7943 N 0 0 0 0 0 2.7994 -0.8639 0.3762 C 0 0 0 0 0 3.3203 0.2840 -0.2190 C 0 0 0 0 0 4.6168 0.2860 -0.6898 C 0 0 0 0 0 5.3997 -0.8489 -0.5740 C 0 0 0 0 0 4.8885 -1.9910 0.0148 C 0 0 0 0 0 3.5939 -2.0028 0.4951 C 0 0 0 0 0 0.8453 2.4144 0.9372 H 0 0 0 0 0 0.2750 1.8516 -0.6523 H 0 0 0 0 0 -0.6234 4.1122 -1.1316 H 0 0 0 0 0 -0.0541 4.6751 0.4579 H 0 0 0 0 0 -2.7823 0.0666 2.6551 H 0 0 0 0 0 -3.2884 1.7255 2.2530 H 0 0 0 0 0 -4.8652 -2.3840 -2.2152 H 0 0 0 0 0 -5.5191 -3.0392 -0.6945 H 0 0 0 0 0 -6.5013 -1.9301 -1.6815 H 0 0 0 0 0 -3.4998 -1.9079 0.8830 H 0 0 0 0 0 1.3499 -2.9041 1.6236 H 0 0 0 0 0 2.7104 1.1706 -0.3094 H 0 0 0 0 0 5.0218 1.1755 -1.1510 H 0 0 0 0 0 6.4138 -0.8430 -0.9460 H 0 0 0 0 0 5.5037 -2.8744 0.1020 H 0 0 0 0 0 3.1957 -2.8952 0.9545 H 0 0 0 0 0 1.1210 4.1786 -0.7831 H 0 0 0 0 0 11 10 1 0 0 0 12 10 1 0 0 0 12 7 2 0 0 0 10 9 2 0 0 0 7 6 1 0 0 0 7 8 1 0 0 0 9 8 1 0 0 0 6 5 1 0 0 0 3 4 1 0 0 0 3 2 1 0 0 0 2 5 1 0 0 0 2 1 2 0 0 0 5 13 1 0 0 0 17 13 2 0 0 0 17 16 1 0 0 0 13 14 1 0 0 0 23 22 2 0 0 0 23 18 1 0 0 0 22 21 1 0 0 0 16 18 1 0 0 0 16 15 2 0 0 0 18 19 2 0 0 0 21 20 2 0 0 0 14 15 1 0 0 0 19 20 1 0 0 0 3 24 1 0 0 0 3 25 1 0 0 0 4 26 1 0 0 0 4 27 1 0 0 0 6 28 1 0 0 0 6 29 1 0 0 0 11 30 1 0 0 0 11 31 1 0 0 0 11 32 1 0 0 0 12 33 1 0 0 0 15 34 1 0 0 0 19 35 1 0 0 0 20 36 1 0 0 0 21 37 1 0 0 0 22 38 1 0 0 0 23 39 1 0 0 0 4 40 1 0 0 0 M END $$$$