C61 Converted by convert_cif2sdf.py 2024/03/29 11:09:15 82 82 0 0 0 0 0 0 0 0999 V2000 10.6941 2.8371 2.2177 C 0 0 0 0 0 10.3009 1.6096 1.6007 O 0 0 0 0 0 8.8863 1.4247 1.5240 C 0 0 0 0 0 8.5819 0.0856 0.8496 C 0 0 0 0 0 7.0677 -0.1118 0.7672 C 0 0 0 0 0 6.7837 -1.3624 0.1366 O 0 0 0 0 0 6.0930 -3.7447 -1.0624 O 0 0 0 0 0 5.6611 -4.9617 -1.6744 C 0 0 0 0 0 4.4833 -0.8342 0.4304 C 0 0 0 0 0 5.4736 -1.6939 -0.0158 C 0 0 0 0 0 5.1243 -2.8977 -0.6214 C 0 0 0 0 0 3.7882 -3.2301 -0.7751 C 0 0 0 0 0 2.8050 -2.3677 -0.3276 C 0 0 0 0 0 3.1520 -1.1727 0.2745 C 0 0 0 0 0 2.0765 -0.2358 0.7609 C 0 0 0 0 0 1.1709 0.1537 -0.4090 C 0 0 0 0 0 1.8892 1.1754 -1.2917 C 0 0 0 0 0 2.3560 2.3529 -0.4327 C 0 0 0 0 0 3.0995 0.5163 -1.9547 C 0 0 0 0 0 -0.1244 0.7643 0.1299 C 0 0 0 0 0 -1.0957 1.0028 -1.0277 C 0 0 0 0 0 -0.5786 2.0743 -1.8888 N 0 0 0 0 0 -2.4619 1.4104 -0.4717 C 0 0 0 0 0 -2.3265 2.6109 0.2914 O 0 0 0 0 0 -3.4333 1.6489 -1.6293 C 0 0 0 0 0 -4.8386 1.8919 -1.0743 C 0 0 0 0 0 -5.7750 2.2956 -2.2150 C 0 0 0 0 0 -5.3489 0.6285 -0.4290 C 0 0 0 0 0 -4.6572 -0.3673 -0.4147 O 0 0 0 0 0 -6.5745 0.6062 0.1315 N 0 0 0 0 0 -7.0700 -0.6211 0.7595 C 0 0 0 0 0 -8.4753 -0.3781 1.3145 C 0 0 0 0 0 -8.9935 -1.6596 1.9690 C 0 0 0 0 0 -10.3988 -1.4176 2.5240 C 0 0 0 0 0 10.3093 2.8714 3.2375 H 0 0 0 0 0 11.7818 2.9009 2.2377 H 0 0 0 0 0 10.2914 3.6746 1.6500 H 0 0 0 0 0 8.4633 1.4303 2.5292 H 0 0 0 0 0 8.4454 2.2335 0.9407 H 0 0 0 0 0 9.0049 0.0811 -0.1556 H 0 0 0 0 0 9.0228 -0.7231 1.4319 H 0 0 0 0 0 6.6447 -0.1072 1.7714 H 0 0 0 0 0 6.6268 0.6969 0.1839 H 0 0 0 0 0 5.0708 -5.5373 -0.9615 H 0 0 0 0 0 5.0520 -4.7321 -2.5490 H 0 0 0 0 0 6.5309 -5.5435 -1.9798 H 0 0 0 0 0 4.7522 0.0988 0.9051 H 0 0 0 0 0 3.5153 -4.1631 -1.2458 H 0 0 0 0 0 1.7639 -2.6278 -0.4481 H 0 0 0 0 0 1.4831 -0.7313 1.5300 H 0 0 0 0 0 2.5355 0.6603 1.1783 H 0 0 0 0 0 0.9361 -0.7341 -0.9976 H 0 0 0 0 0 1.2056 1.5362 -2.0599 H 0 0 0 0 0 -0.5762 0.0824 0.8492 H 0 0 0 0 0 0.0980 1.7137 0.6188 H 0 0 0 0 0 3.0784 2.0007 0.3042 H 0 0 0 0 0 2.8221 3.1049 -1.0689 H 0 0 0 0 0 1.4990 2.7905 0.0803 H 0 0 0 0 0 2.7805 -0.3834 -2.4797 H 0 0 0 0 0 3.5488 1.2109 -2.6634 H 0 0 0 0 0 3.8323 0.2509 -1.1922 H 0 0 0 0 0 -1.1996 0.0871 -1.6099 H 0 0 0 0 0 -1.2002 2.2474 -2.6647 H 0 0 0 0 0 -0.4173 2.9176 -1.3599 H 0 0 0 0 0 -2.8458 0.6156 0.1678 H 0 0 0 0 0 -1.9888 3.3632 -0.2152 H 0 0 0 0 0 -3.1128 2.5208 -2.1994 H 0 0 0 0 0 -3.4457 0.7731 -2.2789 H 0 0 0 0 0 -4.8034 2.6899 -0.3325 H 0 0 0 0 0 -5.3593 3.1574 -2.7373 H 0 0 0 0 0 -5.8791 1.4637 -2.9109 H 0 0 0 0 0 -6.7527 2.5544 -1.8085 H 0 0 0 0 0 -7.1275 1.4036 0.1200 H 0 0 0 0 0 -7.1052 -1.4191 0.0176 H 0 0 0 0 0 -6.4037 -0.9088 1.5713 H 0 0 0 0 0 -8.4401 0.4199 2.0553 H 0 0 0 0 0 -9.1426 -0.0903 0.5016 H 0 0 0 0 0 -9.0287 -2.4585 1.2271 H 0 0 0 0 0 -8.3262 -1.9483 2.7819 H 0 0 0 0 0 -10.3636 -0.6196 3.2658 H 0 0 0 0 0 -11.0651 -1.1289 1.7111 H 0 0 0 0 0 -10.7681 -2.3302 2.9908 H 0 0 0 0 0 1 2 1 0 0 0 1 35 1 0 0 0 1 36 1 0 0 0 1 37 1 0 0 0 2 3 1 0 0 0 3 4 1 0 0 0 3 38 1 0 0 0 3 39 1 0 0 0 4 5 1 0 0 0 4 40 1 0 0 0 4 41 1 0 0 0 5 6 1 0 0 0 5 42 1 0 0 0 5 43 1 0 0 0 6 10 1 0 0 0 7 8 1 0 0 0 7 11 1 0 0 0 8 44 1 0 0 0 8 45 1 0 0 0 8 46 1 0 0 0 9 10 2 0 0 0 9 14 1 0 0 0 9 47 1 0 0 0 10 11 1 0 0 0 11 12 2 0 0 0 12 13 1 0 0 0 12 48 1 0 0 0 13 14 2 0 0 0 13 49 1 0 0 0 14 15 1 0 0 0 15 16 1 0 0 0 15 50 1 0 0 0 15 51 1 0 0 0 16 17 1 0 0 0 16 20 1 0 0 0 16 52 1 0 0 0 17 18 1 0 0 0 17 19 1 0 0 0 17 53 1 0 0 0 18 56 1 0 0 0 18 57 1 0 0 0 18 58 1 0 0 0 19 59 1 0 0 0 19 60 1 0 0 0 19 61 1 0 0 0 20 21 1 0 0 0 20 54 1 0 0 0 20 55 1 0 0 0 21 22 1 0 0 0 21 23 1 0 0 0 21 62 1 0 0 0 22 63 1 0 0 0 22 64 1 0 0 0 23 24 1 0 0 0 23 25 1 0 0 0 23 65 1 0 0 0 24 66 1 0 0 0 25 26 1 0 0 0 25 67 1 0 0 0 25 68 1 0 0 0 26 27 1 0 0 0 26 28 1 0 0 0 26 69 1 0 0 0 27 70 1 0 0 0 27 71 1 0 0 0 27 72 1 0 0 0 28 29 2 0 0 0 28 30 1 0 0 0 30 31 1 0 0 0 30 73 1 0 0 0 31 32 1 0 0 0 31 74 1 0 0 0 31 75 1 0 0 0 32 33 1 0 0 0 32 76 1 0 0 0 32 77 1 0 0 0 33 34 1 0 0 0 33 78 1 0 0 0 33 79 1 0 0 0 34 80 1 0 0 0 34 81 1 0 0 0 34 82 1 0 0 0 M END $$$$