J9E Converted by convert_cif2sdf.py 2024/03/29 11:09:15 49 52 0 0 0 0 0 0 0 0999 V2000 -0.4087 1.2471 0.1684 C 0 0 0 0 0 1.9296 0.8228 0.7045 C 0 0 0 0 0 2.6542 -0.0537 1.7279 C 0 0 0 0 0 4.1080 0.4058 1.8542 C 0 0 0 0 0 4.8020 0.2843 0.4964 C 0 0 0 0 0 4.7660 -1.1735 0.0338 C 0 0 0 0 0 5.4600 -1.2951 -1.3249 C 0 0 0 0 0 6.9137 -0.8345 -1.1978 C 0 0 0 0 0 6.9488 0.6231 -0.7362 C 0 0 0 0 0 6.2558 0.7448 0.6226 C 0 0 0 0 0 4.0763 1.1617 -0.5271 C 0 0 0 0 0 2.6225 0.7012 -0.6532 C 0 0 0 0 0 -1.8037 0.8042 0.0410 C 0 0 0 0 0 -2.8428 1.5777 -0.3712 C 0 0 0 0 0 -4.0093 0.7782 -0.3550 C 0 0 0 0 0 -5.3539 1.0299 -0.6726 C 0 0 0 0 0 -6.2780 0.0297 -0.5543 C 0 0 0 0 0 -5.8993 -1.2360 -0.1211 C 0 0 0 0 0 -4.5835 -1.5051 0.1975 C 0 0 0 0 0 -3.6245 -0.5041 0.0840 C 0 0 0 0 0 -5.7323 2.2557 -1.0930 F 0 0 0 0 0 -6.8276 -2.2107 -0.0094 F 0 0 0 0 0 0.5374 0.3825 0.5830 N 0 0 0 0 0 -2.2696 -0.4686 0.3154 N 0 0 0 0 0 -0.1072 2.3936 -0.1060 O 0 0 0 0 0 1.9549 1.8619 1.0337 H 0 0 0 0 0 2.1605 0.0319 2.6949 H 0 0 0 0 0 2.6299 -1.0928 1.3988 H 0 0 0 0 0 4.1334 1.4439 2.1835 H 0 0 0 0 0 4.6250 -0.2197 2.5827 H 0 0 0 0 0 5.2830 -1.7989 0.7623 H 0 0 0 0 0 3.7309 -1.5016 -0.0568 H 0 0 0 0 0 5.4346 -2.3332 -1.6542 H 0 0 0 0 0 4.9430 -0.6697 -2.0534 H 0 0 0 0 0 7.4307 -1.4600 -0.4693 H 0 0 0 0 0 7.4075 -0.9212 -2.1657 H 0 0 0 0 0 7.9849 0.9502 -0.6454 H 0 0 0 0 0 6.4328 1.2476 -1.4646 H 0 0 0 0 0 6.2802 1.7829 0.9518 H 0 0 0 0 0 6.7718 0.1193 1.3510 H 0 0 0 0 0 4.1017 2.1998 -0.1978 H 0 0 0 0 0 4.5711 1.0751 -1.4949 H 0 0 0 0 0 2.5982 -0.3369 -0.9825 H 0 0 0 0 0 2.1066 1.3266 -1.3827 H 0 0 0 0 0 -2.7867 2.6177 -0.6593 H 0 0 0 0 0 -7.3114 0.2255 -0.7991 H 0 0 0 0 0 -4.2992 -2.4917 0.5338 H 0 0 0 0 0 0.2972 -0.5315 0.8026 H 0 0 0 0 0 -1.7297 -1.2143 0.6217 H 0 0 0 0 0 22 18 1 0 0 0 17 18 1 0 0 0 17 16 2 0 0 0 18 19 2 0 0 0 21 16 1 0 0 0 16 15 1 0 0 0 19 20 1 0 0 0 20 15 2 0 0 0 20 24 1 0 0 0 15 14 1 0 0 0 24 13 1 0 0 0 14 13 2 0 0 0 13 1 1 0 0 0 1 25 2 0 0 0 1 23 1 0 0 0 23 2 1 0 0 0 2 3 1 0 0 0 2 12 1 0 0 0 3 4 1 0 0 0 12 11 1 0 0 0 4 5 1 0 0 0 11 5 1 0 0 0 5 6 1 0 0 0 5 10 1 0 0 0 6 7 1 0 0 0 10 9 1 0 0 0 7 8 1 0 0 0 9 8 1 0 0 0 2 26 1 0 0 0 3 27 1 0 0 0 3 28 1 0 0 0 4 29 1 0 0 0 4 30 1 0 0 0 6 31 1 0 0 0 6 32 1 0 0 0 7 33 1 0 0 0 7 34 1 0 0 0 8 35 1 0 0 0 8 36 1 0 0 0 9 37 1 0 0 0 9 38 1 0 0 0 10 39 1 0 0 0 10 40 1 0 0 0 11 41 1 0 0 0 11 42 1 0 0 0 12 43 1 0 0 0 12 44 1 0 0 0 14 45 1 0 0 0 17 46 1 0 0 0 19 47 1 0 0 0 23 48 1 0 0 0 24 49 1 0 0 0 M END $$$$