JBJ Converted by convert_cif2sdf.py 2024/03/29 11:09:15 65 70 0 0 0 0 0 0 0 0999 V2000 -6.1245 0.6860 0.5931 C 0 0 0 0 0 -7.7623 2.3953 0.7255 C 0 0 0 0 0 -9.1175 4.1624 0.8322 C 0 0 0 0 0 -7.9774 4.8484 0.7279 C 0 0 0 0 0 -5.7579 -0.7701 0.4660 C 0 0 0 0 0 -3.3151 -0.4682 0.0333 C 0 0 0 0 0 -2.0261 -0.8404 0.6464 C 0 0 0 0 0 -0.7049 -0.5908 0.2760 C 0 0 0 0 0 0.3353 -1.0755 1.0610 C 0 0 0 0 0 1.7428 -0.8122 0.6725 C 0 0 0 0 0 2.7870 -1.2983 1.4583 C 0 0 0 0 0 4.0938 -1.0519 1.0948 C 0 0 0 0 0 4.3704 -0.3202 -0.0542 C 0 0 0 0 0 5.7607 0.7148 -1.6588 C 0 0 0 0 0 7.2238 0.8973 -2.0672 C 0 0 0 0 0 7.8866 0.7817 0.2580 C 0 0 0 0 0 6.4235 0.5991 0.6665 C 0 0 0 0 0 3.3311 0.1644 -0.8392 C 0 0 0 0 0 2.0233 -0.0843 -0.4825 C 0 0 0 0 0 0.0565 -1.8093 2.2145 C 0 0 0 0 0 -1.2543 -2.0558 2.5788 C 0 0 0 0 0 -2.2882 -1.5776 1.8048 C 0 0 0 0 0 -3.7890 -1.6682 1.9206 C 0 0 0 0 0 -6.0344 -1.2360 -0.9408 C 0 0 0 0 0 -6.2378 -0.3121 -1.9479 C 0 0 0 0 0 -6.4911 -0.7403 -3.2398 C 0 0 0 0 0 -6.5412 -2.0946 -3.5243 C 0 0 0 0 0 -6.3378 -3.0200 -2.5197 C 0 0 0 0 0 -6.0785 -2.5927 -1.2257 C 0 0 0 0 0 -6.6902 0.1644 -4.2229 F 0 0 0 0 0 -7.4172 1.0490 0.7055 N 0 0 0 0 0 -8.9711 2.8504 0.8298 N 0 0 0 0 0 -4.3355 -0.9447 0.7676 N 0 0 0 0 0 5.6943 -0.0724 -0.4188 N 0 0 0 0 0 7.9529 1.5688 -0.9820 N 0 0 0 0 0 -5.2543 1.5310 0.6002 O 0 0 0 0 0 -3.4378 0.1817 -0.9865 O 0 0 0 0 0 -5.8729 -3.5035 -0.2368 O 0 0 0 0 0 -6.6521 3.6919 0.6240 S 0 0 0 0 0 -10.0819 4.6420 0.9147 H 0 0 0 0 0 -7.8843 5.9240 0.7107 H 0 0 0 0 0 -6.3525 -1.3564 1.1660 H 0 0 0 0 0 -0.4904 -0.0224 -0.6180 H 0 0 0 0 0 2.5715 -1.8664 2.3512 H 0 0 0 0 0 4.9026 -1.4285 1.7038 H 0 0 0 0 0 5.3040 1.6911 -1.4948 H 0 0 0 0 0 5.2241 0.1908 -2.4509 H 0 0 0 0 0 7.6730 -0.0775 -2.2580 H 0 0 0 0 0 7.2765 1.5045 -2.9710 H 0 0 0 0 0 8.4232 1.3059 1.0492 H 0 0 0 0 0 8.3433 -0.1946 0.0940 H 0 0 0 0 0 6.3708 -0.0077 1.5693 H 0 0 0 0 0 5.9752 1.5739 0.8572 H 0 0 0 0 0 3.5487 0.7333 -1.7318 H 0 0 0 0 0 1.2154 0.2892 -1.0954 H 0 0 0 0 0 0.8654 -2.1857 2.8225 H 0 0 0 0 0 -1.4678 -2.6240 3.4719 H 0 0 0 0 0 -4.1047 -2.7115 1.8919 H 0 0 0 0 0 -4.1225 -1.2029 2.8488 H 0 0 0 0 0 -6.1997 0.7446 -1.7264 H 0 0 0 0 0 -6.7381 -2.4263 -4.5327 H 0 0 0 0 0 -6.3768 -4.0763 -2.7422 H 0 0 0 0 0 -8.1073 0.3701 0.7720 H 0 0 0 0 0 7.6023 2.5037 -0.8359 H 0 0 0 0 0 -6.6865 -3.8318 0.1699 H 0 0 0 0 0 4 3 2 0 0 0 4 39 1 0 0 0 3 32 1 0 0 0 39 2 1 0 0 0 32 2 2 0 0 0 2 31 1 0 0 0 31 1 1 0 0 0 36 1 2 0 0 0 1 5 1 0 0 0 30 26 1 0 0 0 25 26 2 0 0 0 25 24 1 0 0 0 5 33 1 0 0 0 5 24 1 0 0 0 37 6 2 0 0 0 33 6 1 0 0 0 33 23 1 0 0 0 26 27 1 0 0 0 6 7 1 0 0 0 24 29 2 0 0 0 23 22 1 0 0 0 7 22 2 0 0 0 7 8 1 0 0 0 22 21 1 0 0 0 8 9 2 0 0 0 21 20 2 0 0 0 9 20 1 0 0 0 9 10 1 0 0 0 27 28 2 0 0 0 29 28 1 0 0 0 29 38 1 0 0 0 10 11 2 0 0 0 10 19 1 0 0 0 11 12 1 0 0 0 19 18 2 0 0 0 12 13 2 0 0 0 18 13 1 0 0 0 17 34 1 0 0 0 17 16 1 0 0 0 13 34 1 0 0 0 14 34 1 0 0 0 14 15 1 0 0 0 35 16 1 0 0 0 35 15 1 0 0 0 3 40 1 0 0 0 4 41 1 0 0 0 5 42 1 0 0 0 8 43 1 0 0 0 11 44 1 0 0 0 12 45 1 0 0 0 14 46 1 0 0 0 14 47 1 0 0 0 15 48 1 0 0 0 15 49 1 0 0 0 16 50 1 0 0 0 16 51 1 0 0 0 17 52 1 0 0 0 17 53 1 0 0 0 18 54 1 0 0 0 19 55 1 0 0 0 20 56 1 0 0 0 21 57 1 0 0 0 23 58 1 0 0 0 23 59 1 0 0 0 25 60 1 0 0 0 27 61 1 0 0 0 28 62 1 0 0 0 31 63 1 0 0 0 35 64 1 0 0 0 38 65 1 0 0 0 M END $$$$