PUBCHEM-ZINC00313942 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 40 0 0 0 0 0 0 0 0999 V2000 -0.0450 1.6650 -0.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1100 0.1750 -0.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3390 -0.4650 1.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4690 -1.8570 1.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3160 -2.5780 -0.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3460 -3.9920 -0.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1840 -4.6520 -1.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0010 -3.9000 -2.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0440 -2.5040 -2.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0990 -1.8310 -1.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -0.4920 -1.3650 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -6.0170 -1.4140 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1210 -6.7310 -2.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7060 -2.5220 2.2660 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3710 -2.1640 3.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3570 -2.3570 4.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1610 -1.9410 5.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0270 -1.3160 6.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0210 -1.1270 5.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8420 -1.5570 3.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0040 -1.4030 3.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4920 -2.4630 2.5260 O 0 5 0 0 0 0 0 0 0 0 0 0 0.8630 2.1500 0.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2240 2.0110 -1.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8950 1.9730 0.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4170 0.1190 1.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4630 -4.6030 0.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1220 -4.3570 -3.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2050 -1.9240 -3.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1290 -6.4700 -2.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6170 -6.5700 -3.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1180 -7.7980 -2.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2140 -3.3930 2.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3070 -2.8140 4.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9420 -2.0940 6.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1850 -0.9820 7.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9590 -0.6530 5.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4320 -0.2180 2.8540 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 11 2 0 0 0 0 3 4 2 0 0 0 0 3 26 1 0 0 0 0 4 5 1 0 0 0 0 4 14 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 8 9 2 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 1 0 0 0 0 12 13 1 0 0 0 0 13 30 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 18 19 2 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 38 2 0 0 0 0 M CHG 1 22 -1 M END