CKD Converted by convert_cif2sdf.py 2024/03/29 11:09:15 75 79 0 0 0 0 0 0 0 0999 V2000 -3.9304 -0.2991 0.6302 C 0 0 0 0 0 -2.4382 -1.8510 -2.1133 C 0 0 0 0 0 -0.0450 -1.7828 -2.1506 C 0 0 0 0 0 -1.1875 -3.8760 -2.3655 C 0 0 0 0 0 -5.5291 -2.1309 -0.0478 C 0 0 0 0 0 -3.0551 0.7857 -0.0018 C 0 0 0 0 0 -2.3363 1.5677 1.0993 C 0 0 0 0 0 -1.5379 2.6862 0.4821 C 0 0 0 0 0 -0.1959 2.4984 0.1818 C 0 0 0 0 0 -0.0704 4.7434 -0.6532 C 0 0 0 0 0 1.7546 1.2040 0.6029 C 0 0 0 0 0 3.9393 0.0699 0.9084 C 0 0 0 0 0 4.6001 -1.2563 1.1802 C 0 0 0 0 0 5.2549 -1.4692 2.3795 C 0 0 0 0 0 6.0315 2.2741 -3.8233 F 0 0 0 0 0 5.5293 1.7444 -2.6860 C 0 0 0 0 0 4.6328 0.6898 -2.7496 C 0 0 0 0 0 4.1197 0.1493 -1.5860 C 0 0 0 0 0 5.9133 2.2516 -1.4562 C 0 0 0 0 0 5.3982 1.7091 -0.2946 C 0 0 0 0 0 4.5001 0.6605 -0.3597 C 0 0 0 0 0 4.5481 -2.2620 0.2327 C 0 0 0 0 0 5.1542 -3.4789 0.4805 C 0 0 0 0 0 5.8141 -3.6911 1.6790 C 0 0 0 0 0 6.4081 -4.8795 1.9215 F 0 0 0 0 0 5.8629 -2.6851 2.6293 C 0 0 0 0 0 2.4311 -0.1345 0.7529 C 0 0 0 0 0 2.4144 2.2212 0.6201 O 0 0 0 0 0 0.4176 1.2702 0.4507 N 0 0 0 0 0 0.5373 3.5324 -0.3877 C 0 0 0 0 0 -1.4084 4.9276 -0.3586 C 0 0 0 0 0 -2.1430 3.9005 0.2084 C 0 0 0 0 0 -3.4506 4.0824 0.4944 F 0 0 0 0 0 -5.0835 0.3546 1.3996 C 0 0 0 0 0 -6.0043 -0.6877 1.8727 N 0 0 0 0 0 -4.4971 -1.1530 -0.4241 N 0 0 0 0 0 -6.6190 -1.4062 0.7479 C 0 0 0 0 0 -3.9868 -1.0179 -1.9939 S 0 0 0 0 0 -3.7184 0.3608 -2.2108 O 0 0 0 0 0 -4.9051 -1.7649 -2.7805 O 0 0 0 0 0 -2.4015 -3.2227 -2.2724 C 0 0 0 0 0 -0.0094 -3.1554 -2.3097 C 0 0 0 0 0 -1.2603 -1.1300 -2.0525 C 0 0 0 0 0 -3.3296 -0.9039 1.3091 H 0 0 0 0 0 0.8757 -1.2196 -2.1076 H 0 0 0 0 0 -1.1589 -4.9491 -2.4903 H 0 0 0 0 0 -5.9631 -2.5702 -0.9459 H 0 0 0 0 0 -5.0843 -2.9158 0.5646 H 0 0 0 0 0 -2.3181 0.3209 -0.6577 H 0 0 0 0 0 -3.6800 1.4651 -0.5820 H 0 0 0 0 0 -3.0716 1.9832 1.7884 H 0 0 0 0 0 -1.6669 0.8993 1.6415 H 0 0 0 0 0 0.5001 5.5471 -1.0958 H 0 0 0 0 0 4.1296 0.7481 1.7405 H 0 0 0 0 0 5.2920 -0.6846 3.1206 H 0 0 0 0 0 4.3353 0.2907 -3.7088 H 0 0 0 0 0 3.4207 -0.6728 -1.6359 H 0 0 0 0 0 6.6151 3.0705 -1.4060 H 0 0 0 0 0 5.6985 2.1040 0.6649 H 0 0 0 0 0 4.0321 -2.0961 -0.7022 H 0 0 0 0 0 5.1120 -4.2641 -0.2597 H 0 0 0 0 0 6.3780 -2.8499 3.5642 H 0 0 0 0 0 2.0399 -0.6431 1.6337 H 0 0 0 0 0 2.2365 -0.7413 -0.1330 H 0 0 0 0 0 -0.1196 0.4659 0.5286 H 0 0 0 0 0 1.5821 3.3879 -0.6216 H 0 0 0 0 0 -1.8815 5.8755 -0.5712 H 0 0 0 0 0 -4.6862 0.9039 2.2533 H 0 0 0 0 0 -5.6173 1.0398 0.7416 H 0 0 0 0 0 -5.5364 -1.3267 2.4971 H 0 0 0 0 0 -7.1317 -0.6957 0.0991 H 0 0 0 0 0 -7.3357 -2.1333 1.1296 H 0 0 0 0 0 -3.3228 -3.7853 -2.3244 H 0 0 0 0 0 0.9397 -3.6651 -2.3875 H 0 0 0 0 0 -1.2880 -0.0580 -1.9276 H 0 0 0 0 0 25 24 1 0 0 0 24 26 2 0 0 0 24 23 1 0 0 0 26 14 1 0 0 0 23 22 2 0 0 0 14 13 2 0 0 0 22 13 1 0 0 0 15 16 1 0 0 0 19 16 2 0 0 0 19 20 1 0 0 0 13 12 1 0 0 0 16 17 1 0 0 0 20 21 2 0 0 0 17 18 2 0 0 0 21 18 1 0 0 0 21 12 1 0 0 0 3 42 2 0 0 0 3 43 1 0 0 0 12 27 1 0 0 0 42 4 1 0 0 0 43 2 2 0 0 0 27 11 1 0 0 0 4 41 2 0 0 0 40 38 2 0 0 0 2 41 1 0 0 0 2 38 1 0 0 0 38 36 1 0 0 0 38 39 2 0 0 0 11 29 1 0 0 0 11 28 2 0 0 0 34 1 1 0 0 0 34 35 1 0 0 0 1 36 1 0 0 0 1 6 1 0 0 0 29 9 1 0 0 0 36 5 1 0 0 0 35 37 1 0 0 0 7 6 1 0 0 0 7 8 1 0 0 0 37 5 1 0 0 0 9 8 2 0 0 0 9 30 1 0 0 0 8 32 1 0 0 0 30 10 2 0 0 0 32 33 1 0 0 0 32 31 2 0 0 0 10 31 1 0 0 0 1 44 1 0 0 0 3 45 1 0 0 0 4 46 1 0 0 0 5 47 1 0 0 0 5 48 1 0 0 0 6 49 1 0 0 0 6 50 1 0 0 0 7 51 1 0 0 0 7 52 1 0 0 0 10 53 1 0 0 0 12 54 1 0 0 0 14 55 1 0 0 0 17 56 1 0 0 0 18 57 1 0 0 0 19 58 1 0 0 0 20 59 1 0 0 0 22 60 1 0 0 0 23 61 1 0 0 0 26 62 1 0 0 0 27 63 1 0 0 0 27 64 1 0 0 0 29 65 1 0 0 0 30 66 1 0 0 0 31 67 1 0 0 0 34 68 1 0 0 0 34 69 1 0 0 0 35 70 1 0 0 0 37 71 1 0 0 0 37 72 1 0 0 0 41 73 1 0 0 0 42 74 1 0 0 0 43 75 1 0 0 0 M END $$$$