0QB Converted by convert_cif2sdf.py 2024/03/29 11:09:15 102105 0 0 0 0 0 0 0 0999 V2000 4.6799 4.3511 -0.3273 C 0 0 0 0 0 4.2177 2.7551 -2.2446 C 0 0 0 0 0 4.7191 1.9354 -0.0056 C 0 0 0 0 0 4.9005 2.1232 1.1789 O 0 0 0 0 0 4.5438 2.9839 -0.8356 N 0 0 0 0 0 4.8092 -0.4240 0.5557 N 0 0 0 0 0 3.7022 -0.9702 1.0970 C 0 0 0 0 0 3.8031 -1.8289 1.9475 O 0 0 0 0 0 4.6896 0.5303 -0.5501 C 0 0 0 0 0 6.1316 -0.7839 1.0723 C 0 0 0 0 0 5.9718 -1.6429 2.3275 C 0 0 0 0 0 6.8847 -1.5624 0.0239 C 0 0 0 0 0 8.2487 -1.3843 -0.1218 C 0 0 0 0 0 6.2148 -2.4578 -0.7879 C 0 0 0 0 0 8.9398 -2.0978 -1.0827 C 0 0 0 0 0 6.9060 -3.1704 -1.7487 C 0 0 0 0 0 8.2680 -2.9895 -1.8979 C 0 0 0 0 0 -0.0968 -0.8895 0.9204 C 0 0 0 0 0 -0.1958 -0.2167 -0.0841 O 0 0 0 0 0 1.2642 -1.2162 1.4781 C 0 0 0 0 0 2.3391 -0.5136 0.6453 C 0 0 0 0 0 1.3491 -0.7378 2.9287 C 0 0 0 0 0 0.9979 0.7265 2.9963 C 0 0 0 0 0 0.0010 1.1945 3.7468 C 0 0 0 0 0 -0.0678 2.9430 3.5389 S 0 0 0 0 0 1.2560 2.8759 2.4584 C 0 0 0 0 0 1.6572 1.6505 2.3202 N 0 0 0 0 0 1.8207 3.9727 1.8277 N 0 0 0 0 0 -3.0976 0.2022 1.4553 C 0 0 0 0 0 -2.5231 -1.1175 0.9380 C 0 0 0 0 0 -3.4606 -2.2657 1.3184 C 0 0 0 0 0 -2.9217 -3.5762 0.7427 C 0 0 0 0 0 -3.7885 -4.7403 1.2263 C 0 0 0 0 0 -3.2496 -6.0519 0.6504 C 0 0 0 0 0 -3.2845 -5.9895 -0.8780 C 0 0 0 0 0 -2.4167 -4.8255 -1.3615 C 0 0 0 0 0 -2.9567 -3.5148 -0.7858 C 0 0 0 0 0 -1.2054 -1.3445 1.5369 N 0 0 0 0 0 -2.1738 1.2600 1.1899 O 0 0 0 0 0 -5.4324 2.5304 0.1766 N 0 0 0 0 0 -4.9991 1.8088 1.2247 C 0 0 0 0 0 -5.0608 2.1612 2.3828 O 0 0 0 0 0 -4.4229 0.4933 0.7487 C 0 0 0 0 0 -4.1931 0.7056 -0.7658 C 0 0 0 0 0 -5.2202 1.8143 -1.0877 C 0 0 0 0 0 -6.0438 3.8571 0.2821 C 0 0 0 0 0 -4.6576 2.7650 -2.1465 C 0 0 0 0 0 -6.5318 1.1958 -1.5730 C 0 0 0 0 0 3.6974 4.7371 -0.0555 H 0 0 0 0 0 5.3249 4.3490 0.5515 H 0 0 0 0 0 5.1187 4.9832 -1.0989 H 0 0 0 0 0 5.1386 2.6836 -2.8243 H 0 0 0 0 0 3.6557 1.8269 -2.3424 H 0 0 0 0 0 3.6171 3.5846 -2.6184 H 0 0 0 0 0 3.7484 0.3638 -1.0738 H 0 0 0 0 0 5.5200 0.3912 -1.2414 H 0 0 0 0 0 6.6844 0.1221 1.3197 H 0 0 0 0 0 5.3169 -1.1346 3.0350 H 0 0 0 0 0 5.5369 -2.6050 2.0567 H 0 0 0 0 0 6.9480 -1.8023 2.7856 H 0 0 0 0 0 8.7735 -0.6874 0.5151 H 0 0 0 0 0 5.1500 -2.6002 -0.6708 H 0 0 0 0 0 10.0046 -1.9579 -1.1972 H 0 0 0 0 0 6.3821 -3.8708 -2.3832 H 0 0 0 0 0 8.8079 -3.5465 -2.6494 H 0 0 0 0 0 1.4227 -2.2932 1.4416 H 0 0 0 0 0 2.2543 0.5655 0.7788 H 0 0 0 0 0 2.2026 -0.7610 -0.4072 H 0 0 0 0 0 0.6501 -1.3069 3.5406 H 0 0 0 0 0 2.3622 -0.8856 3.3016 H 0 0 0 0 0 -0.6517 0.6045 4.3733 H 0 0 0 0 0 1.4201 4.8507 1.9279 H 0 0 0 0 0 2.6181 3.8630 1.2851 H 0 0 0 0 0 -3.2666 0.1289 2.5293 H 0 0 0 0 0 -2.4254 -1.0722 -0.1460 H 0 0 0 0 0 -3.5192 -2.3425 2.4044 H 0 0 0 0 0 -4.4539 -2.0723 0.9142 H 0 0 0 0 0 -1.8949 -3.7247 1.0767 H 0 0 0 0 0 -3.7637 -4.7848 2.3147 H 0 0 0 0 0 -4.8153 -4.5918 0.8914 H 0 0 0 0 0 -2.2229 -6.2003 0.9844 H 0 0 0 0 0 -3.8672 -6.8810 0.9946 H 0 0 0 0 0 -2.9003 -6.9236 -1.2884 H 0 0 0 0 0 -4.3113 -5.8409 -1.2129 H 0 0 0 0 0 -1.3900 -4.9749 -1.0278 H 0 0 0 0 0 -2.4416 -4.7820 -2.4501 H 0 0 0 0 0 -3.9834 -3.3664 -1.1197 H 0 0 0 0 0 -2.3381 -2.6858 -1.1300 H 0 0 0 0 0 -1.1307 -1.8227 2.3778 H 0 0 0 0 0 -1.3097 1.1415 1.6078 H 0 0 0 0 0 -5.1305 -0.3170 0.9197 H 0 0 0 0 0 -3.1764 1.0464 -0.9622 H 0 0 0 0 0 -4.4129 -0.2033 -1.3250 H 0 0 0 0 0 -6.0867 4.1545 1.3291 H 0 0 0 0 0 -5.4465 4.5780 -0.2765 H 0 0 0 0 0 -7.0526 3.8261 -0.1290 H 0 0 0 0 0 -3.7198 3.1903 -1.7912 H 0 0 0 0 0 -4.4812 2.2153 -3.0706 H 0 0 0 0 0 -5.3728 3.5670 -2.3315 H 0 0 0 0 0 -7.2616 1.9860 -1.7535 H 0 0 0 0 0 -6.3554 0.6464 -2.4981 H 0 0 0 0 0 -6.9160 0.5152 -0.8139 H 0 0 0 0 0 1 5 1 0 0 0 1 49 1 0 0 0 1 50 1 0 0 0 1 51 1 0 0 0 2 5 1 0 0 0 2 52 1 0 0 0 2 53 1 0 0 0 2 54 1 0 0 0 3 4 2 0 0 0 3 5 1 0 0 0 6 7 1 0 0 0 6 9 1 0 0 0 6 10 1 0 0 0 7 8 2 0 0 0 9 55 1 0 0 0 9 56 1 0 0 0 10 11 1 0 0 0 10 12 1 0 0 0 10 57 1 0 0 0 11 58 1 0 0 0 11 59 1 0 0 0 11 60 1 0 0 0 12 13 2 0 0 0 12 14 1 0 0 0 13 15 1 0 0 0 13 61 1 0 0 0 14 16 2 0 0 0 14 62 1 0 0 0 15 17 2 0 0 0 15 63 1 0 0 0 16 17 1 0 0 0 16 64 1 0 0 0 17 65 1 0 0 0 18 19 2 0 0 0 18 20 1 0 0 0 20 21 1 0 0 0 20 22 1 0 0 0 20 66 1 0 0 0 21 67 1 0 0 0 21 68 1 0 0 0 22 23 1 0 0 0 22 69 1 0 0 0 22 70 1 0 0 0 23 24 2 0 0 0 23 27 1 0 0 0 24 25 1 0 0 0 24 71 1 0 0 0 25 26 1 0 0 0 26 27 2 0 0 0 26 28 1 0 0 0 28 72 1 0 0 0 28 73 1 0 0 0 29 30 1 0 0 0 29 39 1 0 0 0 29 74 1 0 0 0 30 31 1 0 0 0 30 38 1 0 0 0 30 75 1 0 0 0 31 32 1 0 0 0 31 76 1 0 0 0 31 77 1 0 0 0 32 33 1 0 0 0 32 37 1 0 0 0 32 78 1 0 0 0 33 34 1 0 0 0 33 79 1 0 0 0 33 80 1 0 0 0 34 35 1 0 0 0 34 81 1 0 0 0 34 82 1 0 0 0 35 36 1 0 0 0 35 83 1 0 0 0 35 84 1 0 0 0 36 37 1 0 0 0 36 85 1 0 0 0 36 86 1 0 0 0 37 87 1 0 0 0 37 88 1 0 0 0 38 89 1 0 0 0 39 90 1 0 0 0 40 41 1 0 0 0 40 45 1 0 0 0 40 46 1 0 0 0 41 42 2 0 0 0 41 43 1 0 0 0 43 44 1 0 0 0 43 91 1 0 0 0 44 45 1 0 0 0 44 92 1 0 0 0 44 93 1 0 0 0 45 47 1 0 0 0 45 48 1 0 0 0 46 94 1 0 0 0 46 95 1 0 0 0 46 96 1 0 0 0 47 97 1 0 0 0 47 98 1 0 0 0 47 99 1 0 0 0 48100 1 0 0 0 48101 1 0 0 0 48102 1 0 0 0 3 9 1 0 0 0 7 21 1 0 0 0 18 38 1 0 0 0 29 43 1 0 0 0 M END $$$$