PUBCHEM-ZINC06066091 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 0 0 0 0 0 0999 V2000 2.8450 1.4550 -0.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4890 0.0130 -0.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8600 -0.6520 0.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5500 -2.0010 0.8510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8680 -2.7130 -0.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5090 -4.0680 -0.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8620 -4.6980 -1.1080 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5720 -3.9600 -2.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8650 -2.6590 -2.3520 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5060 -2.0500 -1.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8270 -0.7040 -1.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1310 -4.5520 -3.2540 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1300 -5.8450 -3.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8670 -6.3860 -4.4230 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4990 -6.7750 -2.6220 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8920 -8.0630 -2.9050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6850 -8.4210 -3.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3590 -9.1230 -2.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9370 -9.2730 -0.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5060 -10.2770 0.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5040 -11.1470 -0.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0860 -11.0080 -1.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6770 -9.9970 -2.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3700 -9.9080 -3.7890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4380 -8.7690 -4.3650 O 0 5 0 0 0 0 0 0 0 0 0 0 1.8210 -4.9210 1.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8200 1.5340 -1.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0940 1.9580 -1.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8860 1.9880 0.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3910 -0.1260 1.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8460 -2.4930 1.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5470 -0.2010 -2.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2890 -5.8110 -5.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0630 -7.4290 -4.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7130 -6.4390 -1.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9420 -9.4570 -4.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0720 -7.6720 -4.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7390 -8.6110 -0.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9630 -10.3820 1.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8400 -11.9350 0.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8760 -11.6970 -1.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3340 -4.5200 1.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4590 -5.9440 0.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9030 -4.9710 1.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8550 -10.9910 -4.2490 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 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 2 3 1 0 0 0 0 2 11 2 0 0 0 0 3 4 2 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 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 26 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 32 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 17 36 1 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 21 22 2 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 45 2 0 0 0 0 26 42 1 0 0 0 0 26 43 1 0 0 0 0 26 44 1 0 0 0 0 M CHG 1 25 -1 M END