OTAVA-ZINC04226935 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 27 0 0 1 0 0 0 0 0999 V2000 -0.4910 1.3200 -0.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2090 -0.0290 -0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5150 -0.5280 -1.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6430 -2.5470 -2.6060 C 0 0 3 0 0 0 0 0 0 0 0 0 2.5920 -2.1040 -2.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5960 -2.5200 -3.7130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0100 -3.9290 -4.7050 S 0 0 0 0 0 0 0 0 0 0 0 0 2.0530 -3.5150 -5.6240 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2100 -4.5550 -5.1670 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7580 -4.9060 -3.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8210 -4.0250 -2.1390 C 0 0 3 0 0 0 0 0 0 0 0 0 2.8430 -4.1170 -1.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7940 -4.2940 -1.3330 O 0 5 0 0 0 0 0 0 0 0 0 0 0.1330 2.0740 -0.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4410 1.2550 -0.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7030 1.6640 0.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1370 0.0640 0.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4270 -0.7510 0.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4040 -0.6570 -2.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1940 0.1500 -1.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4260 -2.6590 -3.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6480 -1.6160 -4.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1930 -5.8370 -3.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7690 -5.1520 -3.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1880 -1.8380 -1.3670 N 0 3 0 0 0 0 0 0 0 0 0 0 1.9750 -1.8260 -0.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5910 -2.6200 -0.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 14 1 0 0 0 0 1 15 1 0 0 0 0 1 16 1 0 0 0 0 2 3 1 0 0 0 0 2 17 1 0 0 0 0 2 18 1 0 0 0 0 3 19 1 0 0 0 0 3 20 1 0 0 0 0 3 25 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 11 1 0 0 0 0 4 25 1 0 0 0 0 6 7 1 0 0 0 0 6 21 1 0 0 0 0 6 22 1 0 0 0 0 7 8 2 0 0 0 0 7 9 2 0 0 0 0 7 10 1 0 0 0 0 10 11 1 0 0 0 0 10 23 1 0 0 0 0 10 24 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 M CHG 1 13 -1 M CHG 1 25 1 M END