OTAVA-ZINC04170571 MOE2007 3D Structure written by MMmdl. 26 27 0 0 1 0 0 0 0 0999 V2000 2.2580 1.4930 -0.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4640 0.2210 -0.0120 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7910 -0.3820 0.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2830 0.7610 0.3010 S 0 0 0 0 0 0 0 0 0 0 0 0 0.1440 2.4280 0.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6630 3.4110 0.3130 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6080 3.0350 0.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5270 2.5870 0.0350 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5810 -0.5490 -1.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8970 -1.8950 -1.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4190 -2.9530 -0.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7750 -4.1920 -0.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3930 -4.3860 -1.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9180 -3.3430 -2.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2770 -2.1040 -2.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9280 3.5140 0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2070 0.0610 -2.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6400 -0.7230 -1.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3330 -2.8280 0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1850 -5.0070 0.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8950 -5.3490 -1.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8290 -3.4970 -2.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7050 -1.3030 -2.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0920 0.5990 -0.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5720 1.4700 -0.1720 N 0 3 0 0 0 0 0 0 0 0 0 0 4.1160 2.3260 -0.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 8 1 0 0 0 0 1 25 2 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 9 1 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 8 16 1 0 0 0 0 9 10 1 0 0 0 0 9 17 1 0 0 0 0 9 18 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 19 1 0 0 0 0 12 13 1 0 0 0 0 12 20 1 0 0 0 0 13 14 2 0 0 0 0 13 21 1 0 0 0 0 14 15 1 0 0 0 0 14 22 1 0 0 0 0 15 23 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 M CHG 1 25 1 M END