CVL Converted by convert_cif2sdf.py 2024/03/29 11:09:15 68 71 0 0 0 0 0 0 0 0999 V2000 3.6666 5.8549 -0.0010 C 0 0 0 0 0 2.8288 4.6982 -0.0001 O 0 0 0 0 0 3.4473 3.4875 -0.0010 C 0 0 0 0 0 4.8328 3.4190 -0.0008 C 0 0 0 0 0 5.4655 2.1945 -0.0007 C 0 0 0 0 0 4.7111 1.0184 0.0003 C 0 0 0 0 0 5.3864 -0.2924 0.0004 C 0 0 0 0 0 4.8137 -1.4532 0.0013 N 0 0 0 0 0 5.7263 -2.5045 0.0005 N 0 0 0 0 0 5.3563 -3.9216 0.0054 C 0 0 0 0 0 4.5287 -4.2279 1.2553 C 0 0 0 0 0 4.5302 -4.2369 -1.2427 C 0 0 0 0 0 6.9961 -2.0490 0.0006 C 0 0 0 0 0 8.0144 -2.7093 -0.0002 O 0 0 0 0 0 6.8812 -0.5379 -0.0054 C 0 0 0 0 0 7.5211 0.0561 1.2507 C 0 0 0 0 0 7.5237 0.0461 -1.2653 C 0 0 0 0 0 3.3156 1.0876 0.0011 C 0 0 0 0 0 2.6887 2.3193 0.0059 C 0 0 0 0 0 1.3302 2.3902 0.0068 O 0 0 0 0 0 0.6159 1.1528 0.0017 C 0 0 0 0 0 -0.8885 1.4331 0.0035 C 0 0 0 0 0 -1.6532 0.1077 -0.0016 C 0 0 0 0 0 -3.1576 0.3870 0.0002 C 0 0 0 0 0 -3.8719 -0.8504 -0.0039 O 0 0 0 0 0 -5.2285 -0.7784 -0.0031 C 0 0 0 0 0 -5.9831 -1.9445 -0.0072 C 0 0 0 0 0 -7.3606 -1.8759 -0.0074 C 0 0 0 0 0 -7.9956 -0.6334 -0.0025 C 0 0 0 0 0 -9.4723 -0.5557 -0.0017 C 0 0 0 0 0 -10.2203 0.5757 0.0022 N 0 0 0 0 0 -11.5554 0.1340 0.0010 N 0 0 0 0 0 -11.5246 -1.1536 -0.0050 N 0 0 0 0 0 -10.3097 -1.5723 -0.0108 N 0 0 0 0 0 -7.2341 0.5358 0.0026 C 0 0 0 0 0 -5.8574 0.4592 0.0068 C 0 0 0 0 0 3.0480 6.7526 -0.0011 H 0 0 0 0 0 4.2967 5.8485 0.8891 H 0 0 0 0 0 4.2960 5.8475 -0.8909 H 0 0 0 0 0 5.4171 4.3269 -0.0017 H 0 0 0 0 0 6.5446 2.1434 -0.0015 H 0 0 0 0 0 6.2588 -4.5330 0.0086 H 0 0 0 0 0 5.1165 -4.0030 2.1454 H 0 0 0 0 0 3.6263 -3.6164 1.2522 H 0 0 0 0 0 4.2521 -5.2822 1.2593 H 0 0 0 0 0 5.1204 -4.0190 -2.1336 H 0 0 0 0 0 4.2546 -5.2922 -1.2397 H 0 0 0 0 0 3.6278 -3.6255 -1.2458 H 0 0 0 0 0 8.5810 -0.1954 1.2718 H 0 0 0 0 0 7.4051 1.1401 1.2406 H 0 0 0 0 0 7.0325 -0.3530 2.1356 H 0 0 0 0 0 7.0364 -0.3700 -2.1474 H 0 0 0 0 0 7.4076 1.1301 -1.2634 H 0 0 0 0 0 8.5835 -0.2054 -1.2822 H 0 0 0 0 0 2.7292 0.1806 0.0010 H 0 0 0 0 0 0.8786 0.5845 -0.8903 H 0 0 0 0 0 0.8794 0.5776 0.8897 H 0 0 0 0 0 -1.1512 2.0014 0.8954 H 0 0 0 0 0 -1.1521 2.0073 -0.8846 H 0 0 0 0 0 -1.3905 -0.4605 -0.8936 H 0 0 0 0 0 -1.3897 -0.4675 0.8864 H 0 0 0 0 0 -3.4203 0.9563 0.8921 H 0 0 0 0 0 -3.4212 0.9622 -0.8879 H 0 0 0 0 0 -5.4912 -2.9056 -0.0111 H 0 0 0 0 0 -7.9469 -2.7829 -0.0114 H 0 0 0 0 0 -9.9032 1.4917 0.0072 H 0 0 0 0 0 -7.7219 1.4990 0.0055 H 0 0 0 0 0 -5.2670 1.3643 0.0109 H 0 0 0 0 0 11 10 1 0 0 0 32 33 2 0 0 0 32 31 1 0 0 0 33 34 1 0 0 0 10 12 1 0 0 0 10 9 1 0 0 0 31 30 1 0 0 0 34 30 2 0 0 0 14 13 2 0 0 0 30 29 1 0 0 0 35 29 2 0 0 0 35 36 1 0 0 0 29 28 1 0 0 0 9 13 1 0 0 0 9 8 1 0 0 0 13 15 1 0 0 0 36 26 2 0 0 0 28 27 2 0 0 0 26 27 1 0 0 0 26 25 1 0 0 0 24 25 1 0 0 0 24 23 1 0 0 0 8 7 2 0 0 0 23 22 1 0 0 0 17 15 1 0 0 0 15 7 1 0 0 0 15 16 1 0 0 0 7 6 1 0 0 0 22 21 1 0 0 0 21 20 1 0 0 0 18 6 2 0 0 0 18 19 1 0 0 0 6 5 1 0 0 0 20 19 1 0 0 0 19 3 2 0 0 0 5 4 2 0 0 0 3 4 1 0 0 0 3 2 1 0 0 0 2 1 1 0 0 0 1 37 1 0 0 0 1 38 1 0 0 0 1 39 1 0 0 0 4 40 1 0 0 0 5 41 1 0 0 0 10 42 1 0 0 0 11 43 1 0 0 0 11 44 1 0 0 0 11 45 1 0 0 0 12 46 1 0 0 0 12 47 1 0 0 0 12 48 1 0 0 0 16 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 17 54 1 0 0 0 18 55 1 0 0 0 21 56 1 0 0 0 21 57 1 0 0 0 22 58 1 0 0 0 22 59 1 0 0 0 23 60 1 0 0 0 23 61 1 0 0 0 24 62 1 0 0 0 24 63 1 0 0 0 27 64 1 0 0 0 28 65 1 0 0 0 31 66 1 0 0 0 35 67 1 0 0 0 36 68 1 0 0 0 M END $$$$