JR8 Converted by convert_cif2sdf.py 2024/03/29 11:09:15 66 73 0 0 0 0 0 0 0 0999 V2000 9.9113 7.4059 11.3300 O 0 0 0 0 0 20.5018 8.9208 13.3771 C 0 0 0 0 0 21.8663 8.3673 13.7492 C 0 0 0 0 0 22.5661 8.4706 15.1066 C 0 0 0 0 0 22.4441 7.6870 12.5257 C 0 0 0 0 0 23.8143 7.0103 12.4564 C 0 0 0 0 0 21.4452 7.8145 11.3917 C 0 0 0 0 0 21.6335 7.2728 9.9815 C 0 0 0 0 0 19.5955 9.6689 14.3516 C 0 0 0 0 0 20.2345 8.5757 11.9082 C 0 0 0 0 0 18.9863 8.9188 11.0994 C 0 0 0 0 0 20.5761 6.8587 13.0476 IR 0 0 0 0 0 20.3264 6.5299 15.4497 CL 0 0 0 0 0 20.8942 4.9137 13.0494 N 0 0 0 0 0 21.9525 4.2911 12.7092 C 0 0 0 0 0 22.0737 2.9533 12.7539 C 0 0 0 0 0 19.7520 4.1441 13.5237 C 0 0 0 0 0 21.2897 0.8254 13.1919 O 0 0 0 0 0 21.0850 2.1377 13.1724 C 0 0 0 0 0 19.9136 2.6437 13.5648 C 0 0 0 0 0 10.0065 6.4397 12.3760 S 0 0 0 0 0 15.6566 6.0755 12.8735 C 0 0 0 0 0 11.6036 6.4063 12.5435 C 0 0 0 0 0 9.7086 5.1003 11.8504 O 0 0 0 0 0 12.2918 5.1307 12.4638 C 0 0 0 0 0 13.6259 5.0820 12.5909 C 0 0 0 0 0 12.4434 7.6078 12.7407 C 0 0 0 0 0 13.7620 7.4212 12.8525 C 0 0 0 0 0 17.4501 7.0727 13.8686 C 0 0 0 0 0 16.5255 7.0891 12.9042 C 0 0 0 0 0 9.2732 6.7862 13.7517 N 0 0 0 0 0 14.3395 6.2096 12.7675 C 0 0 0 0 0 18.6989 6.3854 13.7502 N 0 0 0 0 0 18.5565 4.9677 13.9036 C 0 0 0 0 0 17.5387 4.4240 14.3190 O 0 0 0 0 0 23.5438 7.9685 15.0553 H 0 0 0 0 0 22.7113 9.5303 15.3642 H 0 0 0 0 0 21.9466 7.9879 15.8766 H 0 0 0 0 0 23.9713 6.6018 11.4474 H 0 0 0 0 0 24.5989 7.7483 12.6793 H 0 0 0 0 0 23.8580 6.1945 13.1926 H 0 0 0 0 0 20.7479 7.5127 9.3752 H 0 0 0 0 0 22.5237 7.7329 9.5280 H 0 0 0 0 0 21.7648 6.1813 10.0230 H 0 0 0 0 0 18.6688 9.9642 13.8378 H 0 0 0 0 0 19.3518 9.0143 15.2008 H 0 0 0 0 0 20.1135 10.5671 14.7178 H 0 0 0 0 0 19.0958 8.5346 10.0751 H 0 0 0 0 0 18.1063 8.4581 11.5714 H 0 0 0 0 0 18.8575 10.0106 11.0695 H 0 0 0 0 0 22.7973 4.8692 12.3662 H 0 0 0 0 0 23.0075 2.5110 12.4397 H 0 0 0 0 0 20.5081 0.3873 13.5079 H 0 0 0 0 0 19.1111 2.0024 13.8995 H 0 0 0 0 0 15.9592 5.4549 12.0177 H 0 0 0 0 0 15.8211 5.5180 13.8073 H 0 0 0 0 0 11.7306 4.2222 12.3024 H 0 0 0 0 0 14.1324 4.1289 12.5508 H 0 0 0 0 0 12.0085 8.5947 12.7922 H 0 0 0 0 0 14.3919 8.2826 13.0185 H 0 0 0 0 0 17.7034 8.1256 14.0615 H 0 0 0 0 0 16.9546 6.6466 14.7536 H 0 0 0 0 0 17.0539 7.1015 11.9396 H 0 0 0 0 0 15.9468 8.0182 13.0165 H 0 0 0 0 0 9.4107 6.0382 14.4013 H 0 0 0 0 0 9.6552 7.6302 14.1292 H 0 0 0 0 0 1 21 2 0 0 0 2 3 1 0 0 0 2 9 1 0 0 0 2 10 1 0 0 0 2 12 1 0 0 0 3 4 1 0 0 0 3 5 1 0 0 0 3 12 1 0 0 0 5 6 1 0 0 0 5 7 1 0 0 0 5 12 1 0 0 0 7 8 1 0 0 0 7 10 1 0 0 0 7 12 1 0 0 0 10 11 1 0 0 0 10 12 1 0 0 0 12 14 1 0 0 0 12 33 1 0 0 0 14 15 2 0 0 0 14 17 1 0 0 0 15 16 1 0 0 0 16 19 2 0 0 0 17 20 2 0 0 0 17 34 1 0 0 0 18 19 1 0 0 0 19 20 1 0 0 0 21 23 1 0 0 0 21 24 2 0 0 0 21 31 1 0 0 0 22 30 1 0 0 0 22 32 1 0 0 0 23 25 2 0 0 0 23 27 1 0 0 0 25 26 1 0 0 0 26 32 2 0 0 0 27 28 2 0 0 0 28 32 1 0 0 0 29 30 1 0 0 0 29 33 1 0 0 0 33 34 1 0 0 0 34 35 2 0 0 0 33 13 1 0 0 0 4 36 1 0 0 0 4 37 1 0 0 0 4 38 1 0 0 0 6 39 1 0 0 0 6 40 1 0 0 0 6 41 1 0 0 0 8 42 1 0 0 0 8 43 1 0 0 0 8 44 1 0 0 0 9 45 1 0 0 0 9 46 1 0 0 0 9 47 1 0 0 0 11 48 1 0 0 0 11 49 1 0 0 0 11 50 1 0 0 0 15 51 1 0 0 0 16 52 1 0 0 0 18 53 1 0 0 0 20 54 1 0 0 0 22 55 1 0 0 0 22 56 1 0 0 0 25 57 1 0 0 0 26 58 1 0 0 0 27 59 1 0 0 0 28 60 1 0 0 0 29 61 1 0 0 0 29 62 1 0 0 0 30 63 1 0 0 0 30 64 1 0 0 0 31 65 1 0 0 0 31 66 1 0 0 0 M END $$$$