2MD Converted by convert_cif2sdf.py 2024/03/29 11:09:15 75 80 0 0 0 0 0 0 0 0999 V2000 1.5041 -0.8728 0.7928 P 0 0 0 0 0 0.2552 -0.1872 0.0447 O 0 0 0 0 0 1.9419 -0.0117 1.9142 O 0 0 0 0 0 1.0649 -2.3131 1.3623 O 0 0 0 0 0 2.7189 -1.0555 -0.2473 O 0 0 0 0 0 3.7916 -1.6654 0.4716 C 0 0 0 0 0 4.9837 -1.8681 -0.4651 C 0 0 0 0 0 5.4071 -0.6063 -0.9734 O 0 0 0 0 0 6.1334 -2.5224 0.3061 C 0 0 0 0 0 6.6671 -1.4289 1.6517 S 0 0 0 0 0 7.3016 -2.7589 -0.6565 C 0 0 0 0 0 8.7433 -3.3530 0.2693 S 0 0 0 0 0 7.6488 -1.4430 -1.3529 C 0 0 0 0 0 8.1604 -0.4790 -0.3672 N 0 0 0 0 0 8.2358 0.8801 -0.7467 C 0 0 0 0 0 9.0013 1.7882 -0.0090 C 0 0 0 0 0 9.6201 1.4245 0.9795 O 0 0 0 0 0 9.0453 3.0755 -0.4161 N 0 0 0 0 0 8.3473 3.4683 -1.5163 C 0 0 0 0 0 8.4037 4.7810 -1.9104 N 0 0 0 0 0 7.6250 2.6184 -2.2149 N 0 0 0 0 0 7.5457 1.3292 -1.8641 C 0 0 0 0 0 6.7800 0.4446 -2.6083 N 0 0 0 0 0 6.3940 -0.8392 -1.9991 C 0 0 0 0 0 -0.9158 -0.0354 1.1392 P 0 0 0 0 0 -0.4407 0.8124 2.2557 O 0 0 0 0 0 -1.3146 -1.4888 1.7030 O 0 0 0 0 0 -2.2035 0.6475 0.4560 O 0 0 0 0 0 -3.2027 0.7545 1.4722 C 0 0 0 0 0 -4.4597 1.3985 0.8857 C 0 0 0 0 0 -4.9870 0.5729 -0.1658 O 0 0 0 0 0 -6.4244 0.7022 -0.1229 C 0 0 0 0 0 -7.0655 -0.4378 -0.7808 N 0 0 0 0 0 -8.2831 -0.4332 -1.4043 C 0 0 0 0 0 -9.2149 0.5014 -1.6241 N 0 0 0 0 0 -10.3203 0.2187 -2.2770 C 0 0 0 0 0 -11.2494 1.2091 -2.4751 N 0 0 0 0 0 -10.5699 -1.0291 -2.7644 N 0 0 0 0 0 -9.6732 -2.0238 -2.5846 C 0 0 0 0 0 -9.8879 -3.1434 -3.0166 O 0 0 0 0 0 -8.4793 -1.7329 -1.8845 C 0 0 0 0 0 -7.3917 -2.4606 -1.5297 N 0 0 0 0 0 -6.5588 -1.7013 -0.8809 C 0 0 0 0 0 -6.7416 0.7091 1.3944 C 0 0 0 0 0 -7.9774 1.3775 1.6541 O 0 0 0 0 0 -5.5460 1.5119 1.9720 C 0 0 0 0 0 -5.9150 2.8765 2.1808 O 0 0 0 0 0 0.7879 -2.8413 0.6017 H 0 0 0 0 0 3.4663 -2.6306 0.8594 H 0 0 0 0 0 4.0863 -1.0210 1.3003 H 0 0 0 0 0 4.6890 -2.5136 -1.2929 H 0 0 0 0 0 5.8013 -3.4752 0.7186 H 0 0 0 0 0 5.5252 -1.3551 2.3590 H 0 0 0 0 0 7.0156 -3.5017 -1.4011 H 0 0 0 0 0 8.2360 -4.4854 0.7896 H 0 0 0 0 0 8.4054 -1.6224 -2.1180 H 0 0 0 0 0 8.4382 -0.7663 0.5154 H 0 0 0 0 0 9.5707 3.7222 0.0805 H 0 0 0 0 0 7.9138 5.0732 -2.6953 H 0 0 0 0 0 8.9289 5.4179 -1.4024 H 0 0 0 0 0 6.4985 0.6699 -3.5100 H 0 0 0 0 0 5.9916 -1.5063 -2.7612 H 0 0 0 0 0 -1.6178 -2.0087 0.9462 H 0 0 0 0 0 -3.4452 -0.2399 1.8485 H 0 0 0 0 0 -2.8253 1.3696 2.2894 H 0 0 0 0 0 -4.2217 2.3887 0.4960 H 0 0 0 0 0 -6.7400 1.6374 -0.5839 H 0 0 0 0 0 -11.0855 2.1024 -2.1343 H 0 0 0 0 0 -12.0697 1.0164 -2.9548 H 0 0 0 0 0 -11.3954 -1.2040 -3.2421 H 0 0 0 0 0 -5.6083 -2.0219 -0.4807 H 0 0 0 0 0 -6.7595 -0.3057 1.7927 H 0 0 0 0 0 -8.1159 1.3475 2.6106 H 0 0 0 0 0 -5.2017 1.0640 2.9043 H 0 0 0 0 0 -6.6369 2.8758 2.8240 H 0 0 0 0 0 1 2 1 0 0 0 1 3 2 0 0 0 1 4 1 0 0 0 1 5 1 0 0 0 2 25 1 0 0 0 4 48 1 0 0 0 5 6 1 0 0 0 6 7 1 0 0 0 6 49 1 0 0 0 6 50 1 0 0 0 7 8 1 0 0 0 7 9 1 0 0 0 7 51 1 0 0 0 8 24 1 0 0 0 9 10 1 0 0 0 9 11 1 0 0 0 9 52 1 0 0 0 10 53 1 0 0 0 11 12 1 0 0 0 11 13 1 0 0 0 11 54 1 0 0 0 12 55 1 0 0 0 13 14 1 0 0 0 13 24 1 0 0 0 13 56 1 0 0 0 14 15 1 0 0 0 14 57 1 0 0 0 15 16 1 0 0 0 15 22 2 0 0 0 16 17 2 0 0 0 16 18 1 0 0 0 18 19 1 0 0 0 18 58 1 0 0 0 19 20 1 0 0 0 19 21 2 0 0 0 20 59 1 0 0 0 20 60 1 0 0 0 21 22 1 0 0 0 22 23 1 0 0 0 23 24 1 0 0 0 23 61 1 0 0 0 24 62 1 0 0 0 25 26 2 0 0 0 25 27 1 0 0 0 25 28 1 0 0 0 27 63 1 0 0 0 28 29 1 0 0 0 29 30 1 0 0 0 29 64 1 0 0 0 29 65 1 0 0 0 30 31 1 0 0 0 30 46 1 0 0 0 30 66 1 0 0 0 31 32 1 0 0 0 32 33 1 0 0 0 32 44 1 0 0 0 32 67 1 0 0 0 33 34 1 0 0 0 33 43 1 0 0 0 34 35 1 0 0 0 34 41 2 0 0 0 35 36 2 0 0 0 36 37 1 0 0 0 36 38 1 0 0 0 37 68 1 0 0 0 37 69 1 0 0 0 38 39 1 0 0 0 38 70 1 0 0 0 39 40 2 0 0 0 39 41 1 0 0 0 41 42 1 0 0 0 42 43 2 0 0 0 43 71 1 0 0 0 44 45 1 0 0 0 44 46 1 0 0 0 44 72 1 0 0 0 45 73 1 0 0 0 46 47 1 0 0 0 46 74 1 0 0 0 47 75 1 0 0 0 M END $$$$