PUBCHEM-ZINC06537089 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 38 0 0 1 0 0 0 0 0999 V2000 0.0200 0.5900 -2.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3310 0.0940 -0.9650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0120 -0.0320 0.0740 S 0 0 0 0 0 0 0 0 0 0 0 0 2.0710 0.5740 -1.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4260 0.8800 -2.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1560 1.4150 -3.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3720 1.6010 -3.4310 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4200 1.7030 -4.5680 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4290 0.7320 -0.8630 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1220 0.4370 0.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6590 -0.0550 1.3290 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6250 0.6940 0.1280 C 0 0 3 0 0 0 0 0 0 0 0 0 5.7580 1.5060 -0.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3560 -0.5760 -0.4020 C 0 0 3 0 0 0 0 0 0 0 0 0 6.1990 -0.7610 -1.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0610 -1.8040 0.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7240 -1.4310 1.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4500 -0.1130 1.4840 C 0 0 3 0 0 0 0 0 0 0 0 0 8.2980 0.0910 2.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8070 -0.3050 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4520 1.0580 1.3840 C 0 0 3 0 0 0 0 0 0 0 0 0 7.0660 1.9310 1.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7380 1.5960 2.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1250 1.1270 3.7320 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7100 0.7330 -2.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3130 -0.2020 -0.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4220 1.5740 -4.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9070 2.0720 -5.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9490 1.1150 -1.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9990 -2.0390 0.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5440 -2.6950 0.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9920 -1.3260 2.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4390 -2.2080 2.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4760 -1.1550 -0.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2280 0.5900 -0.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9020 2.5150 2.3840 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 5 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 27 1 0 0 0 0 8 28 1 0 0 0 0 9 10 1 0 0 0 0 9 29 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 21 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 20 1 0 0 0 0 16 17 1 0 0 0 0 16 30 1 0 0 0 0 16 31 1 0 0 0 0 17 18 1 0 0 0 0 17 32 1 0 0 0 0 17 33 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 21 1 0 0 0 0 20 34 1 0 0 0 0 20 35 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 23 24 2 0 0 0 0 23 36 1 0 0 0 0 M CHG 1 36 -1 M END