JNV Converted by convert_cif2sdf.py 2024/03/29 11:09:15 20 20 0 0 0 0 0 0 0 0999 V2000 -3.8911 -0.9176 0.2882 C 0 0 0 0 0 1.9442 0.1311 0.6390 C 0 0 0 0 0 0.4401 0.1677 0.7211 C 0 0 0 0 0 -0.1056 0.1640 1.7992 O 0 0 0 0 0 -0.3831 0.2073 -0.5397 C 0 0 0 0 0 -1.8468 0.2384 -0.1832 C 0 0 0 0 0 -2.4881 1.4484 -0.0011 C 0 0 0 0 0 -3.8309 1.4785 0.3247 C 0 0 0 0 0 -4.5340 0.2963 0.4704 C 0 0 0 0 0 -6.2209 0.3332 0.8802 CL 0 0 0 0 0 -4.7734 -2.4015 0.4626 CL 0 0 0 0 0 -2.5477 -0.9445 -0.0385 C 0 0 0 0 0 2.3636 0.1055 1.6448 H 0 0 0 0 0 2.2576 -0.7588 0.0918 H 0 0 0 0 0 2.3014 1.0204 0.1193 H 0 0 0 0 0 -0.1299 1.0995 -1.1108 H 0 0 0 0 0 -0.1737 -0.6797 -1.1384 H 0 0 0 0 0 -1.9400 2.3726 -0.1148 H 0 0 0 0 0 -4.3316 2.4249 0.4674 H 0 0 0 0 0 -2.0461 -1.8908 -0.1802 H 0 0 0 0 0 10 9 1 0 0 0 9 8 2 0 0 0 9 1 1 0 0 0 8 7 1 0 0 0 11 1 1 0 0 0 1 12 2 0 0 0 7 6 2 0 0 0 12 6 1 0 0 0 6 5 1 0 0 0 5 3 1 0 0 0 3 4 2 0 0 0 3 2 1 0 0 0 2 13 1 0 0 0 2 14 1 0 0 0 2 15 1 0 0 0 5 16 1 0 0 0 5 17 1 0 0 0 7 18 1 0 0 0 8 19 1 0 0 0 12 20 1 0 0 0 M END $$$$