PUBCHEM-ZINC05979224 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 60 0 0 1 0 0 0 0 0999 V2000 -0.2950 -2.5480 1.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5860 -2.7110 0.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0780 -1.3480 -0.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2020 -1.1660 -2.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9990 -0.8550 1.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9680 0.6680 1.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7000 1.2170 2.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4590 2.6400 2.9730 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4170 3.6720 2.5880 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.3380 3.4570 3.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8030 4.9560 3.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3440 6.1780 3.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7050 6.4600 2.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8040 6.2060 3.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0690 6.4670 3.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3020 6.9490 1.8000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.2200 7.1990 1.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9150 6.9790 1.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6680 7.2580 3.7100 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4480 4.6220 3.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5480 5.3620 3.9560 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3000 3.1350 3.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3150 2.5260 3.9110 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6770 3.6850 1.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6480 3.9320 0.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9110 3.9350 -1.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2030 3.7000 -1.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2270 3.4700 -0.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9770 3.4540 0.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4820 3.2660 -1.2530 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1780 -3.5240 1.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4140 -1.9100 0.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4640 -2.1100 2.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3640 -3.1690 -0.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3160 -3.3350 1.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7810 -0.5120 -0.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6450 -2.2840 -0.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4920 -1.9870 -2.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8250 -1.1270 -3.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6360 -0.2300 -2.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5190 -1.2550 2.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0160 -1.2580 1.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9240 1.0090 1.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4180 1.0770 0.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7780 1.0370 2.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3290 0.7110 3.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6860 5.8150 4.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9570 6.2880 3.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4340 7.5890 0.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0880 7.1910 0.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2440 8.0420 3.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6300 4.1200 0.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1080 4.1270 -1.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4150 3.7100 -2.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7910 3.2700 1.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1230 3.3330 -0.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2230 -1.3560 0.3290 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.4540 -0.6890 0.1710 H 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 34 1 0 0 0 0 2 35 1 0 0 0 0 2 57 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 3 57 1 0 0 0 0 4 38 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 41 1 0 0 0 0 5 42 1 0 0 0 0 5 57 1 0 0 0 0 6 7 1 0 0 0 0 6 43 1 0 0 0 0 6 44 1 0 0 0 0 7 8 1 0 0 0 0 7 45 1 0 0 0 0 7 46 1 0 0 0 0 8 9 1 0 0 0 0 8 22 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 24 1 0 0 0 0 11 12 2 0 0 0 0 11 20 1 0 0 0 0 12 13 1 0 0 0 0 12 19 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 47 1 0 0 0 0 15 16 1 0 0 0 0 15 48 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 17 49 1 0 0 0 0 18 50 1 0 0 0 0 19 51 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 2 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 52 1 0 0 0 0 26 27 1 0 0 0 0 26 53 1 0 0 0 0 27 28 2 0 0 0 0 27 54 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 29 55 1 0 0 0 0 30 56 1 0 0 0 0 57 58 1 0 0 0 0 M CHG 1 57 1 M END