PUBCHEM-ZINC01069832 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 46 0 0 0 0 0 0 0 0999 V2000 0.0860 -0.3540 3.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0920 0.0190 1.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0240 0.2070 2.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7580 0.1910 3.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1380 0.4400 3.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8360 0.7170 2.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1430 0.7330 1.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7620 0.4840 1.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2710 0.9880 2.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8600 2.1690 2.8300 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1100 3.4050 3.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9020 3.5490 2.9260 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.8830 4.4450 3.5050 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.2380 4.4800 3.7150 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6870 5.4980 4.2430 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.9650 3.3400 3.3510 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.3540 2.1790 2.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9550 1.2190 2.3590 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.4100 3.3550 3.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1540 4.5330 3.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.5490 4.5430 3.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.2530 3.3760 3.7790 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.5190 2.2000 3.9620 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1240 2.1900 3.8240 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.7600 3.3890 3.9230 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.3430 4.5030 3.7400 O 0 5 0 0 0 0 0 0 0 0 0 0 0.0390 0.4760 4.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1470 -0.5390 3.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3080 -1.2610 4.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1600 -0.1720 1.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0110 1.0100 0.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2710 -0.7390 0.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2690 -0.0100 4.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6520 0.4210 4.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6600 0.9490 0.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2770 0.5180 0.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8700 0.0970 2.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3990 5.3070 3.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6780 5.4680 3.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.0920 5.4750 3.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.0360 1.2760 4.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6160 1.2460 4.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.3230 2.2880 4.2140 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6530 -0.0350 2.4540 N 0 0 0 0 0 0 0 0 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 44 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 2 44 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 3 44 1 0 0 0 0 4 5 2 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 8 36 1 0 0 0 0 9 10 2 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 17 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 19 1 0 0 0 0 17 18 2 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 24 42 1 0 0 0 0 25 26 1 0 0 0 0 25 43 2 0 0 0 0 M CHG 1 26 -1 M END