J2D Converted by convert_cif2sdf.py 2024/03/29 11:09:15 48 50 0 0 0 0 0 0 0 0999 V2000 4.1649 -0.3155 1.1167 C 0 0 0 0 0 5.1823 -1.4469 0.9488 C 0 0 0 0 0 5.3314 -1.7502 -0.4396 O 0 0 0 0 0 4.1294 -2.1955 -1.0714 C 0 0 0 0 0 3.0698 -1.0947 -0.9842 C 0 0 0 0 0 2.8343 -0.7377 0.4867 C 0 0 0 0 0 1.8491 0.3985 0.5787 C 0 0 0 0 0 2.1776 1.4449 1.0970 O 0 0 0 0 0 0.6044 0.2530 0.0854 N 0 0 0 0 0 -0.3530 1.3580 0.1743 C 0 0 0 0 0 -0.1551 2.2902 -0.9933 C 0 0 0 0 0 0.7014 2.0539 -1.8193 O 0 0 0 0 0 -0.9301 3.3855 -1.1202 N 0 0 0 0 0 -0.7444 4.2614 -2.2176 O 0 0 0 0 0 -1.7574 0.8105 0.1469 C 0 0 0 0 0 -2.7261 1.3572 0.9691 C 0 0 0 0 0 -4.0131 0.8585 0.9482 C 0 0 0 0 0 -2.0731 -0.2331 -0.7035 C 0 0 0 0 0 -3.3565 -0.7390 -0.7321 C 0 0 0 0 0 -4.3356 -0.1961 0.0976 C 0 0 0 0 0 -5.7176 -0.7367 0.0715 C 0 0 0 0 0 -6.0391 -1.7912 -0.7801 C 0 0 0 0 0 -7.3270 -2.2922 -0.8019 C 0 0 0 0 0 -7.6396 -3.3155 -1.6267 F 0 0 0 0 0 -8.2987 -1.7447 0.0223 C 0 0 0 0 0 -9.5575 -2.2363 -0.0024 F 0 0 0 0 0 -7.9829 -0.6942 0.8702 C 0 0 0 0 0 -8.9328 -0.1648 1.6714 F 0 0 0 0 0 -6.6949 -0.1925 0.9020 C 0 0 0 0 0 4.0177 -0.1134 2.1781 H 0 0 0 0 0 4.5343 0.5829 0.6232 H 0 0 0 0 0 6.1431 -1.1349 1.3577 H 0 0 0 0 0 4.8322 -2.3325 1.4794 H 0 0 0 0 0 4.3313 -2.4235 -2.1176 H 0 0 0 0 0 3.7649 -3.0917 -0.5681 H 0 0 0 0 0 3.4161 -0.2121 -1.5215 H 0 0 0 0 0 2.1385 -1.4489 -1.4276 H 0 0 0 0 0 2.4409 -1.6064 1.0145 H 0 0 0 0 0 0.3418 -0.5839 -0.3294 H 0 0 0 0 0 -0.1936 1.9029 1.1051 H 0 0 0 0 0 -1.6149 3.5748 -0.4602 H 0 0 0 0 0 -1.3452 5.0181 -2.2233 H 0 0 0 0 0 -2.4748 2.1746 1.6280 H 0 0 0 0 0 -4.7687 1.2864 1.5908 H 0 0 0 0 0 -1.3134 -0.6535 -1.3467 H 0 0 0 0 0 -3.6020 -1.5541 -1.3971 H 0 0 0 0 0 -5.2826 -2.2180 -1.4218 H 0 0 0 0 0 -6.4497 0.6252 1.5629 H 0 0 0 0 0 26 25 1 0 0 0 24 23 1 0 0 0 25 23 2 0 0 0 25 27 1 0 0 0 28 27 1 0 0 0 23 22 1 0 0 0 27 29 2 0 0 0 22 21 2 0 0 0 29 21 1 0 0 0 21 20 1 0 0 0 20 17 2 0 0 0 20 19 1 0 0 0 17 16 1 0 0 0 19 18 2 0 0 0 16 15 2 0 0 0 18 15 1 0 0 0 15 10 1 0 0 0 10 9 1 0 0 0 10 11 1 0 0 0 8 7 2 0 0 0 9 7 1 0 0 0 7 6 1 0 0 0 11 12 2 0 0 0 11 13 1 0 0 0 6 1 1 0 0 0 6 5 1 0 0 0 1 2 1 0 0 0 13 14 1 0 0 0 5 4 1 0 0 0 2 3 1 0 0 0 4 3 1 0 0 0 1 30 1 0 0 0 1 31 1 0 0 0 2 32 1 0 0 0 2 33 1 0 0 0 4 34 1 0 0 0 4 35 1 0 0 0 5 36 1 0 0 0 5 37 1 0 0 0 6 38 1 0 0 0 9 39 1 0 0 0 10 40 1 0 0 0 13 41 1 0 0 0 14 42 1 0 0 0 16 43 1 0 0 0 17 44 1 0 0 0 18 45 1 0 0 0 19 46 1 0 0 0 22 47 1 0 0 0 29 48 1 0 0 0 M END $$$$