JNK Converted by convert_cif2sdf.py 2024/03/29 11:09:15 56 59 0 0 0 0 0 0 0 0999 V2000 -3.7479 -0.1912 -0.4295 C 0 0 0 0 0 -2.4553 -0.9184 -0.3693 C 0 0 0 0 0 -4.9372 -0.8153 -0.0551 C 0 0 0 0 0 -3.8054 1.1362 -0.8690 C 0 0 0 0 0 -1.2949 -0.2803 0.0689 C 0 0 0 0 0 -2.3692 -2.2623 -0.7506 C 0 0 0 0 0 -6.1240 -0.0949 -0.1211 C 0 0 0 0 0 -5.0240 1.7787 -0.9110 C 0 0 0 0 0 -0.1069 -0.9986 0.1100 C 0 0 0 0 0 -1.1506 -2.9033 -0.6804 C 0 0 0 0 0 -7.3184 -0.7007 0.2542 N 0 0 0 0 0 -6.1309 1.1601 -0.5439 N 0 0 0 0 0 1.0608 -0.3757 0.5455 N 0 0 0 0 0 -0.0713 -2.2682 -0.2658 N 0 0 0 0 0 -8.4970 0.0512 0.3101 C 0 0 0 0 0 2.2383 -1.0267 0.4767 C 0 0 0 0 0 -9.7034 -0.5183 -0.0739 C 0 0 0 0 0 -8.4626 1.3661 0.7546 C 0 0 0 0 0 3.5179 -0.3105 0.8265 C 0 0 0 0 0 2.2689 -2.1894 0.1324 O 0 0 0 0 0 -10.8664 0.2249 -0.0184 C 0 0 0 0 0 -9.6266 2.1087 0.8030 C 0 0 0 0 0 4.6990 -1.2698 0.6660 C 0 0 0 0 0 3.7031 0.8881 -0.1059 C 0 0 0 0 0 -10.8280 1.5390 0.4191 C 0 0 0 0 0 5.9981 -0.5429 1.0224 C 0 0 0 0 0 5.0021 1.6140 0.2505 C 0 0 0 0 0 6.1833 0.6558 0.0900 C 0 0 0 0 0 7.3961 1.3349 0.4225 O 0 0 0 0 0 7.8862 1.9206 -0.7857 C 0 0 0 0 0 -11.9669 2.2651 0.4719 F 0 0 0 0 0 -4.9350 -1.8385 0.2894 H 0 0 0 0 0 -2.9049 1.6511 -1.1713 H 0 0 0 0 0 -1.3204 0.7560 0.3718 H 0 0 0 0 0 -3.2463 -2.7894 -1.0945 H 0 0 0 0 0 -5.0742 2.8029 -1.2497 H 0 0 0 0 0 -1.0781 -3.9404 -0.9731 H 0 0 0 0 0 -7.3341 -1.6447 0.4785 H 0 0 0 0 0 1.0258 0.5272 0.8976 H 0 0 0 0 0 -9.7333 -1.5430 -0.4155 H 0 0 0 0 0 -7.5252 1.8114 1.0537 H 0 0 0 0 0 3.4693 0.0360 1.8592 H 0 0 0 0 0 -11.8047 -0.2174 -0.3163 H 0 0 0 0 0 -9.5998 3.1326 1.1436 H 0 0 0 0 0 4.7486 -1.6164 -0.3657 H 0 0 0 0 0 4.5671 -2.1235 1.3308 H 0 0 0 0 0 3.7527 0.5405 -1.1376 H 0 0 0 0 0 2.8614 1.5709 0.0084 H 0 0 0 0 0 6.8398 -1.2257 0.9081 H 0 0 0 0 0 5.9485 -0.1963 2.0541 H 0 0 0 0 0 4.9526 1.9616 1.2822 H 0 0 0 0 0 5.1341 2.4687 -0.4143 H 0 0 0 0 0 6.2319 0.3093 -0.9426 H 0 0 0 0 0 8.0702 1.1374 -1.5204 H 0 0 0 0 0 7.1458 2.6194 -1.1767 H 0 0 0 0 0 8.8150 2.4523 -0.5804 H 0 0 0 0 0 1 2 1 0 0 0 1 3 2 0 0 0 1 4 1 0 0 0 2 5 1 0 0 0 2 6 2 0 0 0 3 7 1 0 0 0 3 32 1 0 0 0 4 8 2 0 0 0 4 33 1 0 0 0 5 9 2 0 0 0 5 34 1 0 0 0 6 10 1 0 0 0 6 35 1 0 0 0 7 11 1 0 0 0 7 12 2 0 0 0 8 12 1 0 0 0 8 36 1 0 0 0 9 13 1 0 0 0 9 14 1 0 0 0 10 14 2 0 0 0 10 37 1 0 0 0 11 15 1 0 0 0 11 38 1 0 0 0 13 16 1 0 0 0 13 39 1 0 0 0 15 17 2 0 0 0 15 18 1 0 0 0 16 19 1 0 0 0 16 20 2 0 0 0 17 21 1 0 0 0 17 40 1 0 0 0 18 22 2 0 0 0 18 41 1 0 0 0 19 23 1 0 0 0 19 24 1 0 0 0 19 42 1 0 0 0 21 25 2 0 0 0 21 43 1 0 0 0 22 25 1 0 0 0 22 44 1 0 0 0 23 26 1 0 0 0 23 45 1 0 0 0 23 46 1 0 0 0 24 27 1 0 0 0 24 47 1 0 0 0 24 48 1 0 0 0 25 31 1 0 0 0 26 28 1 0 0 0 26 49 1 0 0 0 26 50 1 0 0 0 27 28 1 0 0 0 27 51 1 0 0 0 27 52 1 0 0 0 28 29 1 0 0 0 28 53 1 0 0 0 29 30 1 0 0 0 30 54 1 0 0 0 30 55 1 0 0 0 30 56 1 0 0 0 M END $$$$