C47 Converted by convert_cif2sdf.py 2024/03/29 11:09:15 78 79 0 0 0 0 0 0 0 0999 V2000 14.5064 51.4987 71.3138 C 0 0 0 0 0 14.5836 50.0063 71.6045 O 0 0 0 0 0 14.1705 49.2528 70.4564 C 0 0 0 0 0 14.0228 49.8903 69.3849 O 0 0 0 0 0 13.8573 47.8050 70.4514 C 0 0 0 0 0 14.9122 47.4043 69.4432 C 0 0 0 0 0 14.7478 45.9893 69.0565 C 0 0 0 0 0 15.8586 45.0806 68.9297 C 0 0 0 0 0 15.5430 43.6379 68.5773 C 0 0 0 0 0 14.2455 43.1392 68.4490 C 0 0 0 0 0 13.1578 44.0049 68.6671 C 0 0 0 0 0 13.4075 45.4580 69.0197 C 0 0 0 0 0 12.3224 46.4926 69.2287 N 0 0 0 0 0 12.6117 47.7929 69.6986 C 0 0 0 0 0 10.9828 46.1996 68.9022 C 0 0 0 0 0 10.6899 45.0987 68.4055 O 0 0 0 0 0 9.8674 47.1931 69.2473 C 0 0 0 0 0 8.9100 46.4351 70.0305 C 0 0 0 0 0 9.5180 45.7307 71.1782 C 0 0 0 0 0 8.1524 45.3470 69.2373 C 0 0 0 0 0 7.9539 47.3746 70.5631 C 0 0 0 0 0 7.3195 48.0975 69.3852 C 0 0 0 0 0 8.0322 49.5057 69.4003 N 0 0 0 0 0 5.8191 48.3627 69.5919 C 0 0 0 0 0 5.9835 49.5305 70.4955 O 0 0 0 0 0 5.3288 48.7787 68.1200 C 0 0 0 0 0 3.8679 49.1903 68.2723 C 0 0 0 0 0 3.4995 50.1313 67.0839 C 0 0 0 0 0 3.0705 47.8864 68.5462 C 0 0 0 0 0 3.5592 46.8276 68.3899 O 0 0 0 0 0 1.8836 47.9067 69.0044 N 0 0 0 0 0 1.1649 46.7844 69.5583 C 0 0 0 0 0 2.0259 46.2191 70.5163 C 0 0 0 0 0 1.1388 45.6979 71.5722 C 0 0 0 0 0 0.4620 44.4937 70.7747 C 0 0 0 0 0 13.9810 52.0065 72.1363 H 0 0 0 0 0 15.5239 51.9069 71.2211 H 0 0 0 0 0 13.9580 51.6613 70.3742 H 0 0 0 0 0 13.8147 47.2413 71.3955 H 0 0 0 0 0 14.8136 48.0360 68.5487 H 0 0 0 0 0 15.9058 47.5360 69.8957 H 0 0 0 0 0 11.7938 48.1283 70.3532 H 0 0 0 0 0 12.7145 48.4664 68.8343 H 0 0 0 0 0 16.8755 45.4122 69.0800 H 0 0 0 0 0 16.3684 42.9599 68.4168 H 0 0 0 0 0 14.0794 42.1053 68.1867 H 0 0 0 0 0 12.1470 43.6348 68.5833 H 0 0 0 0 0 10.2626 48.0419 69.8248 H 0 0 0 0 0 9.4091 47.6217 68.3442 H 0 0 0 0 0 8.7518 45.5519 71.9469 H 0 0 0 0 0 9.9297 44.7682 70.8407 H 0 0 0 0 0 10.3255 46.3475 71.6007 H 0 0 0 0 0 8.7445 45.0540 68.3579 H 0 0 0 0 0 7.9926 44.4688 69.8805 H 0 0 0 0 0 7.1800 45.7435 68.9086 H 0 0 0 0 0 7.1831 46.8441 71.1416 H 0 0 0 0 0 8.4486 48.0903 71.2354 H 0 0 0 0 0 7.4266 47.5061 68.4637 H 0 0 0 0 0 7.7211 50.0293 70.1937 H 0 0 0 0 0 9.0222 49.3779 69.4529 H 0 0 0 0 0 5.1327 47.5962 69.9802 H 0 0 0 0 0 5.7154 49.2908 71.3746 H 0 0 0 0 0 5.9306 49.6137 67.7301 H 0 0 0 0 0 5.4430 47.9490 67.4064 H 0 0 0 0 0 3.6070 49.8252 69.1319 H 0 0 0 0 0 2.9589 51.0103 67.4652 H 0 0 0 0 0 4.4190 50.4583 66.5766 H 0 0 0 0 0 2.8605 49.5891 66.3719 H 0 0 0 0 0 1.4030 48.7835 68.9784 H 0 0 0 0 0 0.2251 47.1148 70.0250 H 0 0 0 0 0 0.8899 46.0557 68.7809 H 0 0 0 0 0 2.6290 45.4116 70.0750 H 0 0 0 0 0 2.7417 46.9558 70.9091 H 0 0 0 0 0 1.6851 45.3665 72.4672 H 0 0 0 0 0 0.4348 46.4316 71.9926 H 0 0 0 0 0 1.1156 44.1911 69.9430 H 0 0 0 0 0 0.3143 43.6413 71.4544 H 0 0 0 0 0 -0.5105 44.8184 70.3766 H 0 0 0 0 0 1 2 1 0 0 0 2 3 1 0 0 0 3 4 2 0 0 0 3 5 1 0 0 0 5 6 1 0 0 0 5 14 1 0 0 0 6 7 1 0 0 0 7 8 1 0 0 0 7 12 2 0 0 0 8 9 2 0 0 0 9 10 1 0 0 0 10 11 2 0 0 0 11 12 1 0 0 0 12 13 1 0 0 0 13 14 1 0 0 0 13 15 1 0 0 0 15 16 2 0 0 0 15 17 1 0 0 0 17 18 1 0 0 0 18 19 1 0 0 0 18 20 1 0 0 0 18 21 1 0 0 0 21 22 1 0 0 0 22 23 1 0 0 0 22 24 1 0 0 0 24 25 1 0 0 0 24 26 1 0 0 0 26 27 1 0 0 0 27 28 1 0 0 0 27 29 1 0 0 0 29 30 2 0 0 0 29 31 1 0 0 0 31 32 1 0 0 0 32 33 1 0 0 0 33 34 1 0 0 0 34 35 1 0 0 0 1 36 1 0 0 0 1 37 1 0 0 0 1 38 1 0 0 0 5 39 1 0 0 0 6 40 1 0 0 0 6 41 1 0 0 0 14 42 1 0 0 0 14 43 1 0 0 0 8 44 1 0 0 0 9 45 1 0 0 0 10 46 1 0 0 0 11 47 1 0 0 0 17 48 1 0 0 0 17 49 1 0 0 0 19 50 1 0 0 0 19 51 1 0 0 0 19 52 1 0 0 0 20 53 1 0 0 0 20 54 1 0 0 0 20 55 1 0 0 0 21 56 1 0 0 0 21 57 1 0 0 0 22 58 1 0 0 0 23 59 1 0 0 0 23 60 1 0 0 0 24 61 1 0 0 0 25 62 1 0 0 0 26 63 1 0 0 0 26 64 1 0 0 0 27 65 1 0 0 0 28 66 1 0 0 0 28 67 1 0 0 0 28 68 1 0 0 0 31 69 1 0 0 0 32 70 1 0 0 0 32 71 1 0 0 0 33 72 1 0 0 0 33 73 1 0 0 0 34 74 1 0 0 0 34 75 1 0 0 0 35 76 1 0 0 0 35 77 1 0 0 0 35 78 1 0 0 0 M END $$$$