FTK Converted by convert_cif2sdf.py 2024/03/29 11:09:15 27 27 0 0 0 0 0 0 0 0999 V2000 3.7613 -0.7400 0.0048 C 0 0 0 0 0 5.0880 -1.1156 0.0024 C 0 0 0 0 0 6.0831 -0.1534 -0.0010 C 0 0 0 0 0 5.7556 1.1913 -0.0021 C 0 0 0 0 0 4.4338 1.5829 0.0003 C 0 0 0 0 0 3.4226 0.6176 -0.0022 C 0 0 0 0 0 2.0087 1.0266 0.0002 C 0 0 0 0 0 1.7193 2.2046 0.0040 O 0 0 0 0 0 0.9220 -0.0162 -0.0024 C 0 0 0 0 0 -0.4248 0.6603 0.0002 C 0 0 0 0 0 -0.4944 1.8658 0.0040 O 0 0 0 0 0 -1.6840 -0.1667 -0.0013 C 0 0 0 0 0 -2.8845 0.7448 0.0025 C 0 0 0 0 0 -2.7320 1.9429 0.0052 O 0 0 0 0 0 -4.2733 0.1609 0.0012 C 0 0 0 0 0 -4.9583 0.5853 1.1445 F 0 0 0 0 0 -4.9595 0.5918 -1.1394 F 0 0 0 0 0 -4.1924 -1.2356 -0.0037 F 0 0 0 0 0 2.9856 -1.4905 0.0084 H 0 0 0 0 0 5.3504 -2.1627 0.0037 H 0 0 0 0 0 7.1203 -0.4551 -0.0023 H 0 0 0 0 0 6.5383 1.9358 0.0003 H 0 0 0 0 0 4.1803 2.6331 0.0000 H 0 0 0 0 0 1.0154 -0.6359 -0.8949 H 0 0 0 0 0 1.0166 -0.6421 0.8851 H 0 0 0 0 0 -1.7066 -0.7933 -0.8937 H 0 0 0 0 0 -1.7054 -0.7985 0.8863 H 0 0 0 0 0 14 13 2 0 0 0 18 15 1 0 0 0 16 15 1 0 0 0 13 15 1 0 0 0 13 12 1 0 0 0 4 5 2 0 0 0 4 3 1 0 0 0 5 6 1 0 0 0 9 10 1 0 0 0 9 7 1 0 0 0 15 17 1 0 0 0 11 10 2 0 0 0 10 12 1 0 0 0 3 2 2 0 0 0 6 7 1 0 0 0 6 1 2 0 0 0 7 8 2 0 0 0 2 1 1 0 0 0 1 19 1 0 0 0 2 20 1 0 0 0 3 21 1 0 0 0 4 22 1 0 0 0 5 23 1 0 0 0 9 24 1 0 0 0 9 25 1 0 0 0 12 26 1 0 0 0 12 27 1 0 0 0 M END $$$$