PUBCHEM-ZINC02548460 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 58 0 0 0 0 0 0 0 0999 V2000 -0.1590 1.1300 -0.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0650 0.9000 2.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7920 3.0570 1.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7320 3.4720 2.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7850 4.9700 2.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6180 5.5820 1.6610 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6160 6.9180 1.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4710 7.5720 0.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5270 8.9640 0.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7130 9.7270 1.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8480 9.0940 2.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7870 7.6780 2.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9480 6.9370 3.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9350 5.5870 3.3450 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0790 7.5730 4.2460 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9310 6.8110 4.9510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8130 7.7570 5.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8950 6.9800 6.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1360 7.2290 7.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0610 8.2320 8.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4290 8.8090 9.4630 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2420 9.5200 9.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2180 8.5860 8.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1720 0.0380 -0.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8590 1.5180 -0.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8100 1.5430 -0.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0780 1.3110 2.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0850 -0.1790 2.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4480 1.1010 3.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1630 3.4310 0.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2290 3.4290 1.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7390 3.0740 2.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3940 3.0960 3.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1140 6.9840 0.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2060 9.4460 0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7480 10.8120 1.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2200 9.7250 3.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1770 8.5620 4.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4550 6.0850 5.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5550 6.2600 4.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2730 8.4980 5.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1820 8.3120 6.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4780 6.2940 7.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5020 6.4110 5.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5930 6.8330 6.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8580 6.4120 8.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9680 7.7230 8.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3670 9.0300 7.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8230 9.9510 10.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5020 10.3490 8.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9300 7.7780 9.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3370 9.1470 8.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7110 1.5430 1.2170 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.6700 1.1660 1.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8360 7.9260 7.2280 N 0 3 0 0 0 0 0 0 0 0 0 0 4.0910 8.6740 6.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 53 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 2 53 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 3 53 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 14 2 0 0 0 0 6 7 2 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 34 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 10 11 2 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 37 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 15 16 1 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 18 43 1 0 0 0 0 18 44 1 0 0 0 0 18 55 1 0 0 0 0 19 20 1 0 0 0 0 19 45 1 0 0 0 0 19 46 1 0 0 0 0 19 55 1 0 0 0 0 20 21 1 0 0 0 0 20 47 1 0 0 0 0 20 48 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 49 1 0 0 0 0 22 50 1 0 0 0 0 23 51 1 0 0 0 0 23 52 1 0 0 0 0 23 55 1 0 0 0 0 53 54 1 0 0 0 0 55 56 1 0 0 0 0 M CHG 1 53 1 M CHG 1 55 1 M END