PUBCHEM-ZINC05824945 MOE2007 3D CORINA 3.40 0006 02.08.2006 65 68 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 0.7630 -2.0410 1.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5030 -2.5480 2.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5240 -4.0770 2.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2320 -4.5630 3.6510 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6740 -4.8490 4.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6640 -5.2630 5.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8270 -5.2380 4.9730 N 0 3 0 0 0 0 0 0 0 0 0 0 3.5730 -4.8210 3.7470 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7460 -4.8000 3.0260 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8430 -4.5310 2.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7470 -5.2230 3.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1710 -5.4930 5.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9950 -5.9570 6.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5150 -6.2160 7.2220 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3170 -6.1090 5.9150 N 0 0 0 0 0 0 0 0 0 0 0 0 7.8580 -5.8270 4.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0540 -5.9750 4.5550 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1020 -5.4050 3.6850 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7280 -5.1150 2.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1770 -6.5880 7.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2500 -8.1160 6.9550 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3990 -10.0290 7.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4120 -10.4610 8.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8380 -10.1790 10.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5030 -8.6890 10.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5160 -8.3080 9.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2180 -4.7220 5.2430 C 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 -1.0200 -0.3810 0.0100 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 1.7650 -0.1340 1.2340 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 -0.2600 -2.4180 1.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2730 -2.3920 0.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5250 -2.1700 2.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9930 -2.1960 3.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5010 -4.4550 2.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0340 -4.4290 1.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5570 -5.5650 6.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0490 -4.0740 2.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5920 -5.7650 2.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0080 -5.2910 1.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1780 -6.1730 6.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7640 -6.2720 7.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2500 -8.5310 7.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6640 -8.4320 5.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8110 -10.2160 6.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4780 -10.5980 8.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6130 -11.5280 8.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3380 -9.9020 8.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9320 -10.7680 10.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5740 -10.4450 11.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0540 -8.4890 11.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4150 -8.1020 10.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5990 -8.8860 9.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2870 -7.2450 9.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2940 -5.6610 5.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1310 -4.4920 6.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2360 -3.9210 4.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1130 -8.5960 8.0430 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 4 5 1 0 0 0 0 4 38 1 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 40 1 0 0 0 0 5 41 1 0 0 0 0 6 7 1 0 0 0 0 6 42 1 0 0 0 0 6 43 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 2 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 9 44 1 0 0 0 0 10 11 2 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 14 21 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 23 24 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 24 50 1 0 0 0 0 24 51 1 0 0 0 0 24 65 1 0 0 0 0 25 26 1 0 0 0 0 25 52 1 0 0 0 0 25 53 1 0 0 0 0 25 65 1 0 0 0 0 26 27 1 0 0 0 0 26 54 1 0 0 0 0 26 55 1 0 0 0 0 27 28 1 0 0 0 0 27 56 1 0 0 0 0 27 57 1 0 0 0 0 28 29 1 0 0 0 0 28 58 1 0 0 0 0 28 59 1 0 0 0 0 29 60 1 0 0 0 0 29 61 1 0 0 0 0 29 65 1 0 0 0 0 30 62 1 0 0 0 0 30 63 1 0 0 0 0 30 64 1 0 0 0 0 M CHG 1 10 1 M END