FJG Converted by convert_cif2sdf.py 2024/03/29 11:09:15 77 81 0 0 0 0 0 0 0 0999 V2000 2.7839 0.3637 2.2458 C 0 0 0 0 0 3.3879 1.7689 4.3103 C 0 0 0 0 0 5.1620 0.1561 3.2653 C 0 0 0 0 0 -0.8142 2.5441 0.7127 C 0 0 0 0 0 0.3761 3.4273 0.4418 C 0 0 0 0 0 0.8393 3.2305 -1.0027 C 0 0 0 0 0 0.2199 3.5367 -3.4034 C 0 0 0 0 0 2.5941 3.8209 -2.6808 C 0 0 0 0 0 -4.4372 2.4335 0.8147 C 0 0 0 0 0 2.1751 -4.3526 -2.5570 C 0 0 0 0 0 1.4370 -4.5573 -1.2321 C 0 0 0 0 0 1.2252 -3.2596 -0.5856 N 0 0 0 0 0 2.1937 -2.7242 0.1843 C 0 0 0 0 0 3.2423 -3.3172 0.3426 O 0 0 0 0 0 1.9793 -1.4148 0.8365 C 0 0 0 0 0 0.7774 -0.7333 0.6571 C 0 0 0 0 0 0.5871 0.5034 1.2714 C 0 0 0 0 0 1.5974 1.0484 2.0668 C 0 0 0 0 0 2.9821 -0.8583 1.6355 C 0 0 0 0 0 3.8699 0.9585 3.1056 C 0 0 0 0 0 5.1495 1.4226 2.4062 C 0 0 0 0 0 -0.6848 1.2338 1.0862 C 0 0 0 0 0 -2.3035 0.5709 1.3075 S 0 0 0 0 0 -2.9981 2.1305 0.8740 C 0 0 0 0 0 -2.0386 2.9758 0.6126 N 0 0 0 0 0 -0.2442 3.7337 -1.9589 C 0 0 0 0 0 1.5105 4.3232 -3.6371 C 0 0 0 0 0 2.1309 4.0178 -1.2363 C 0 0 0 0 0 -4.8118 3.5478 0.5017 O 0 0 0 0 0 -5.3396 1.4761 1.1073 N 0 0 0 0 0 -6.7719 1.7773 1.0476 C 0 0 0 0 0 -7.4877 1.1352 -0.1528 C 0 0 0 0 0 -7.7273 -0.0893 0.7456 C 0 0 0 0 0 -7.6301 0.8692 1.9443 C 0 0 0 0 0 -9.0927 -0.7049 0.5748 C 0 0 0 0 0 -9.8759 -0.2294 -0.2127 O 0 0 0 0 0 -9.4384 -1.7817 1.2978 O 0 0 0 0 0 0.0852 -5.2210 -1.4977 C 0 0 0 0 0 -0.5897 -5.4077 -0.2866 F 0 0 0 0 0 -0.6801 -4.4025 -2.3359 F 0 0 0 0 0 0.2873 -6.4596 -2.1155 F 0 0 0 0 0 3.2078 1.0980 5.1508 H 0 0 0 0 0 4.1485 2.4991 4.5846 H 0 0 0 0 0 2.4634 2.2869 4.0538 H 0 0 0 0 0 5.6698 0.2061 4.2285 H 0 0 0 0 0 5.2278 -0.8019 2.7481 H 0 0 0 0 0 0.0983 4.4700 0.5961 H 0 0 0 0 0 1.1859 3.1633 1.1223 H 0 0 0 0 0 1.0220 2.1717 -1.1852 H 0 0 0 0 0 0.4015 2.4771 -3.5861 H 0 0 0 0 0 -0.5526 3.8950 -4.0846 H 0 0 0 0 0 2.7757 2.7613 -2.8634 H 0 0 0 0 0 3.5141 4.3806 -2.8469 H 0 0 0 0 0 1.5788 -3.7143 -3.2096 H 0 0 0 0 0 3.1385 -3.8798 -2.3670 H 0 0 0 0 0 2.3324 -5.3178 -3.0372 H 0 0 0 0 0 2.0334 -5.1946 -0.5794 H 0 0 0 0 0 0.3888 -2.7862 -0.7114 H 0 0 0 0 0 0.0001 -1.1590 0.0408 H 0 0 0 0 0 1.4502 2.0057 2.5437 H 0 0 0 0 0 3.9142 -1.3858 1.7755 H 0 0 0 0 0 5.6485 2.3055 2.8055 H 0 0 0 0 0 5.2066 1.2984 1.3252 H 0 0 0 0 0 -1.1633 3.1729 -1.7930 H 0 0 0 0 0 -0.4259 4.7924 -1.7764 H 0 0 0 0 0 1.8407 4.1832 -4.6658 H 0 0 0 0 0 1.3289 5.3828 -3.4545 H 0 0 0 0 0 1.9492 5.0765 -1.0538 H 0 0 0 0 0 2.9024 3.6586 -0.5553 H 0 0 0 0 0 -5.0406 0.5876 1.3560 H 0 0 0 0 0 -6.9867 2.8386 1.1690 H 0 0 0 0 0 -8.4031 1.6507 -0.4420 H 0 0 0 0 0 -6.8285 0.9345 -0.9973 H 0 0 0 0 0 -6.9227 -0.8242 0.7075 H 0 0 0 0 0 -7.0854 0.4532 2.7927 H 0 0 0 0 0 -8.5846 1.3120 2.2287 H 0 0 0 0 0 -10.3243 -2.1422 1.1540 H 0 0 0 0 0 10 11 1 0 0 0 14 13 2 0 0 0 39 38 1 0 0 0 40 38 1 0 0 0 38 11 1 0 0 0 38 41 1 0 0 0 36 35 2 0 0 0 11 12 1 0 0 0 13 12 1 0 0 0 13 15 1 0 0 0 35 33 1 0 0 0 35 37 1 0 0 0 16 15 2 0 0 0 16 17 1 0 0 0 32 33 1 0 0 0 32 31 1 0 0 0 15 19 1 0 0 0 33 34 1 0 0 0 5 4 1 0 0 0 5 6 1 0 0 0 29 9 2 0 0 0 4 25 1 0 0 0 4 22 2 0 0 0 25 24 2 0 0 0 22 17 1 0 0 0 22 23 1 0 0 0 17 18 2 0 0 0 24 23 1 0 0 0 24 9 1 0 0 0 9 30 1 0 0 0 19 1 2 0 0 0 30 31 1 0 0 0 31 34 1 0 0 0 18 1 1 0 0 0 26 6 1 0 0 0 26 7 1 0 0 0 1 20 1 0 0 0 6 28 1 0 0 0 21 20 1 0 0 0 21 3 1 0 0 0 20 2 1 0 0 0 20 3 1 0 0 0 28 8 1 0 0 0 7 27 1 0 0 0 27 8 1 0 0 0 2 42 1 0 0 0 2 43 1 0 0 0 2 44 1 0 0 0 3 45 1 0 0 0 3 46 1 0 0 0 5 47 1 0 0 0 5 48 1 0 0 0 6 49 1 0 0 0 7 50 1 0 0 0 7 51 1 0 0 0 8 52 1 0 0 0 8 53 1 0 0 0 10 54 1 0 0 0 10 55 1 0 0 0 10 56 1 0 0 0 11 57 1 0 0 0 12 58 1 0 0 0 16 59 1 0 0 0 18 60 1 0 0 0 19 61 1 0 0 0 21 62 1 0 0 0 21 63 1 0 0 0 26 64 1 0 0 0 26 65 1 0 0 0 27 66 1 0 0 0 27 67 1 0 0 0 28 68 1 0 0 0 28 69 1 0 0 0 30 70 1 0 0 0 31 71 1 0 0 0 32 72 1 0 0 0 32 73 1 0 0 0 33 74 1 0 0 0 34 75 1 0 0 0 34 76 1 0 0 0 37 77 1 0 0 0 M END $$$$