CUP Converted by convert_cif2sdf.py 2024/03/29 11:09:15 34 37 0 0 0 0 0 0 0 0999 V2000 -2.8164 8.9812 1.6405 O 0 0 0 0 0 -1.9553 8.4982 2.3694 C 0 0 0 0 0 -1.3119 9.2517 3.4154 O 0 0 0 0 0 -1.5198 7.0625 2.2897 C 0 0 0 0 0 -2.4505 6.3310 3.2712 C 0 0 0 0 0 -2.2950 4.8312 3.3247 C 0 0 0 0 0 -2.7060 4.0377 2.2448 C 0 0 0 0 0 -2.5543 2.6438 2.3049 C 0 0 0 0 0 -2.0042 2.0652 3.4531 C 0 0 0 0 0 -1.5818 2.8510 4.5305 C 0 0 0 0 0 -1.7427 4.2503 4.4735 C 0 0 0 0 0 -0.1476 6.8598 2.7919 N 0 0 0 0 0 0.5055 8.0464 4.1432 CU 0 0 0 0 0 0.5406 5.8963 2.3302 C 0 0 0 0 0 1.9566 5.5423 2.6002 C 0 0 0 0 0 2.7985 6.1754 3.5126 C 0 0 0 0 0 2.3955 7.1876 4.3266 O 0 0 0 0 0 4.1237 5.7289 3.6485 C 0 0 0 0 0 4.6066 4.6932 2.8690 C 0 0 0 0 0 3.7679 4.0671 1.9619 C 0 0 0 0 0 2.4553 4.4861 1.8279 C 0 0 0 0 0 -1.9040 0.9916 3.5086 H 0 0 0 0 0 -1.1362 2.3895 5.3995 H 0 0 0 0 0 -1.4437 4.8682 5.3072 H 0 0 0 0 0 -3.1385 4.4979 1.3683 H 0 0 0 0 0 -2.8586 2.0253 1.4738 H 0 0 0 0 0 -2.2579 6.7271 4.2790 H 0 0 0 0 0 -3.4887 6.5529 2.9820 H 0 0 0 0 0 -1.6413 6.6659 1.2708 H 0 0 0 0 0 4.7734 6.2003 4.3704 H 0 0 0 0 0 5.6333 4.3742 2.9668 H 0 0 0 0 0 4.1381 3.2513 1.3586 H 0 0 0 0 0 1.8076 3.9926 1.1180 H 0 0 0 0 0 0.0220 5.2425 1.6443 H 0 0 0 0 0 1 2 2 0 0 0 2 4 1 0 0 0 2 3 1 0 0 0 3 13 1 0 0 0 4 5 1 0 0 0 4 29 1 0 0 0 4 12 1 0 0 0 5 6 1 0 0 0 5 27 1 0 0 0 5 28 1 0 0 0 6 11 1 0 0 0 6 7 2 0 0 0 7 25 1 0 0 0 7 8 1 0 0 0 8 9 2 0 0 0 8 26 1 0 0 0 9 22 1 0 0 0 9 10 1 0 0 0 10 23 1 0 0 0 10 11 2 0 0 0 11 24 1 0 0 0 12 14 2 0 0 0 12 13 1 0 0 0 13 17 1 0 0 0 14 15 1 0 0 0 14 34 1 0 0 0 15 21 2 0 0 0 15 16 1 0 0 0 16 17 1 0 0 0 16 18 2 0 0 0 18 30 1 0 0 0 18 19 1 0 0 0 19 31 1 0 0 0 19 20 2 0 0 0 20 32 1 0 0 0 20 21 1 0 0 0 21 33 1 0 0 0 M END $$$$