J2V Converted by convert_cif2sdf.py 2024/03/29 11:09:15 44 47 0 0 0 0 0 0 0 0999 V2000 -1.1793 -1.4942 -0.9813 C 0 0 0 0 0 -1.7879 -0.6830 -0.0261 C 0 0 0 0 0 2.1254 1.1331 -0.0743 C 0 0 0 0 0 -2.1936 -3.3773 -0.1156 C 0 0 0 0 0 -2.8323 -2.6351 0.8716 C 0 0 0 0 0 -2.6347 -1.2686 0.9234 C 0 0 0 0 0 5.6215 0.1449 -0.1465 C 0 0 0 0 0 0.9857 -0.3286 1.4569 C 0 0 0 0 0 2.1968 -0.9340 1.7145 C 0 0 0 0 0 -1.7055 -5.4271 -1.2107 C 0 0 0 0 0 -2.5291 1.8366 -0.2650 C 0 0 0 0 0 -1.8348 3.0538 -0.1458 C 0 0 0 0 0 -2.5307 4.2462 -0.3404 C 0 0 0 0 0 -3.8770 4.1775 -0.6445 C 0 0 0 0 0 -4.4962 2.9405 -0.7465 C 0 0 0 0 0 -3.8252 1.8249 -0.5598 N 0 0 0 0 0 -1.5420 0.7775 -0.0136 C 0 0 0 0 0 -0.3419 1.4092 0.2365 C 0 0 0 0 0 -0.5230 2.7690 0.1616 N 0 0 0 0 0 0.9344 0.7329 0.5414 C 0 0 0 0 0 3.2990 -0.5361 1.1060 N 0 0 0 0 0 3.2994 0.4653 0.2389 C 0 0 0 0 0 -1.3997 -2.7930 -0.9979 N 0 0 0 0 0 4.4951 0.8523 -0.3664 N 0 0 0 0 0 5.6164 -0.7714 0.6475 O 0 0 0 0 0 6.8855 0.4927 -0.8890 C 0 0 0 0 0 -2.3882 -4.7180 -0.1755 O 0 0 0 0 0 -0.5239 -1.0527 -1.7187 H 0 0 0 0 0 2.1295 1.9467 -0.7843 H 0 0 0 0 0 -3.4793 -3.1204 1.5878 H 0 0 0 0 0 -3.1209 -0.6676 1.6768 H 0 0 0 0 0 0.0881 -0.6679 1.9518 H 0 0 0 0 0 2.2430 -1.7518 2.4183 H 0 0 0 0 0 -0.6296 -5.2922 -1.0962 H 0 0 0 0 0 -1.9466 -6.4887 -1.1453 H 0 0 0 0 0 -2.0182 -5.0428 -2.1815 H 0 0 0 0 0 -2.0298 5.1989 -0.2554 H 0 0 0 0 0 -4.4445 5.0833 -0.8006 H 0 0 0 0 0 -5.5489 2.8927 -0.9837 H 0 0 0 0 0 0.1715 3.4312 0.2977 H 0 0 0 0 0 4.5157 1.6304 -0.9440 H 0 0 0 0 0 7.6840 -0.1835 -0.5831 H 0 0 0 0 0 6.7174 0.3934 -1.9609 H 0 0 0 0 0 7.1713 1.5189 -0.6591 H 0 0 0 0 0 26 7 1 0 0 0 21 9 2 0 0 0 21 22 1 0 0 0 24 7 1 0 0 0 24 22 1 0 0 0 9 8 1 0 0 0 7 25 2 0 0 0 22 3 2 0 0 0 8 20 2 0 0 0 3 20 1 0 0 0 5 6 2 0 0 0 5 4 1 0 0 0 20 18 1 0 0 0 27 4 1 0 0 0 27 10 1 0 0 0 6 2 1 0 0 0 4 23 2 0 0 0 18 17 2 0 0 0 18 19 1 0 0 0 2 17 1 0 0 0 2 1 2 0 0 0 23 1 1 0 0 0 17 11 1 0 0 0 19 12 1 0 0 0 11 12 2 0 0 0 11 16 1 0 0 0 12 13 1 0 0 0 16 15 2 0 0 0 13 14 2 0 0 0 15 14 1 0 0 0 1 28 1 0 0 0 3 29 1 0 0 0 5 30 1 0 0 0 6 31 1 0 0 0 8 32 1 0 0 0 9 33 1 0 0 0 10 34 1 0 0 0 10 35 1 0 0 0 10 36 1 0 0 0 13 37 1 0 0 0 14 38 1 0 0 0 15 39 1 0 0 0 19 40 1 0 0 0 24 41 1 0 0 0 26 42 1 0 0 0 26 43 1 0 0 0 26 44 1 0 0 0 M END $$$$