PUBCHEM-ZINC06754594 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 52 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3720 -0.5110 0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3110 -0.2790 0.9750 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4220 -0.8820 0.6660 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2680 -1.5360 -0.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9530 -1.3010 -0.9470 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5460 -1.8350 -2.0940 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3670 -2.5750 -2.8210 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6170 -2.8200 -2.4500 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1030 -2.3330 -1.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4090 -2.5920 -0.9350 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.2660 -3.4250 -1.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6280 -3.5510 -1.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9560 -4.6880 -0.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2060 -4.8040 0.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1290 -3.7830 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8050 -2.6450 -0.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5500 -2.5230 -1.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2270 -1.4020 -1.9740 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9050 -3.1140 -4.0110 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7930 -3.9380 -4.8350 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0420 -4.4040 -6.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9700 -5.2640 -6.9450 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2680 -5.6990 -8.1120 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -1.6010 1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1550 0.3160 1.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7570 -2.2220 -0.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3630 -2.9640 -2.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8210 -4.4140 -1.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2370 -5.4870 -0.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4610 -5.6940 0.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1040 -3.8760 0.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5270 -1.8480 -0.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4430 -1.4470 -2.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9940 -2.9450 -4.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1190 -4.8060 -4.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6620 -3.3510 -5.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7160 -3.5360 -6.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1730 -4.9910 -5.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2950 -6.1320 -6.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8390 -4.6770 -7.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7960 -6.2510 -8.7050 H 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 4 1 0 0 0 0 2 30 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 8 1 0 0 0 0 5 6 2 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 22 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 14 37 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 38 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 18 19 2 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 26 50 1 0 0 0 0 M END