Y3 Converted by convert_cif2sdf.py 2024/03/29 11:09:15 34 35 0 0 0 0 0 0 0 0999 V2000 1.5839 1.6330 0.4389 C 0 0 0 0 0 2.9598 1.5963 0.4210 C 0 0 0 0 0 3.6394 0.3824 0.4108 C 0 0 0 0 0 2.9645 -0.7996 0.4200 C 0 0 0 0 0 1.5589 -0.8049 0.4386 C 0 0 0 0 0 0.8585 0.4252 0.4419 C 0 0 0 0 0 -0.5501 0.4191 0.4674 C 0 0 0 0 0 -1.2221 -0.7850 0.4764 C 0 0 0 0 0 -0.5240 -1.9878 0.4672 C 0 0 0 0 0 0.8379 -2.0100 0.4486 C 0 0 0 0 0 5.4010 0.3744 0.3889 S 0 0 0 0 0 5.7998 1.6340 0.9080 O 0 0 0 0 0 5.7887 -0.8898 0.9087 O 0 0 0 0 0 5.8367 0.3724 -1.0692 O 0 0 0 0 0 -1.2595 1.6214 0.4764 N 0 0 0 0 0 -2.5154 1.6669 -0.0080 C 0 0 0 0 0 -2.9914 0.6916 -0.5496 O 0 0 0 0 0 -3.3292 2.9286 0.1211 C 0 0 0 0 0 -1.4155 -3.5067 0.4795 S 0 0 0 0 0 -0.5153 -4.4790 0.9936 O 0 0 0 0 0 -2.6932 -3.2003 1.0233 O 0 0 0 0 0 -1.6666 -3.8991 -0.9684 O 0 0 0 0 0 0.9306 2.8238 0.4484 O 0 0 0 0 0 3.5187 2.5207 0.4145 H 0 0 0 0 0 3.5081 -1.7332 0.4143 H 0 0 0 0 0 -2.3011 -0.7933 0.4916 H 0 0 0 0 0 1.3618 -2.9542 0.4418 H 0 0 0 0 0 6.8040 0.3685 -1.0723 H 0 0 0 0 0 -0.8484 2.4250 0.8329 H 0 0 0 0 0 -4.3108 2.7754 -0.3254 H 0 0 0 0 0 -3.4455 3.1792 1.1746 H 0 0 0 0 0 -2.8193 3.7436 -0.3913 H 0 0 0 0 0 -2.1557 -4.7335 -0.9512 H 0 0 0 0 0 0.7840 3.0688 -0.4749 H 0 0 0 0 0 1 2 2 0 0 0 1 6 1 0 0 0 1 23 1 0 0 0 2 3 1 0 0 0 2 24 1 0 0 0 3 4 2 0 0 0 3 11 1 0 0 0 4 5 1 0 0 0 4 25 1 0 0 0 5 6 2 0 0 0 5 10 1 0 0 0 6 7 1 0 0 0 7 8 2 0 0 0 7 15 1 0 0 0 8 9 1 0 0 0 8 26 1 0 0 0 9 10 2 0 0 0 9 19 1 0 0 0 10 27 1 0 0 0 11 12 2 0 0 0 11 13 2 0 0 0 11 14 1 0 0 0 14 28 1 0 0 0 15 16 1 0 0 0 15 29 1 0 0 0 16 17 2 0 0 0 16 18 1 0 0 0 18 30 1 0 0 0 18 31 1 0 0 0 18 32 1 0 0 0 19 20 2 0 0 0 19 21 2 0 0 0 19 22 1 0 0 0 22 33 1 0 0 0 23 34 1 0 0 0 M END $$$$