PUBCHEM-ZINC03678580 MOE2007 3D CORINA 3.40 0006 02.08.2006 61 64 0 0 1 0 0 0 0 0999 V2000 0.4090 0.6720 -3.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2730 -0.7030 -2.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1610 -1.3260 -2.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0890 -0.3820 -1.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7020 -1.4620 -3.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1790 -2.7240 -1.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0300 -3.3370 -1.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0830 -4.5940 -0.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2880 -5.2860 -0.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4580 -4.7240 -0.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3890 -3.4390 -1.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7760 -5.4710 -0.8610 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.5960 -6.5520 -0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8000 -5.1680 -1.9090 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1230 -4.8380 -1.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7400 -4.6590 -2.9600 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0370 -4.3090 -3.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3120 -4.2270 -4.7560 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3180 -4.4880 -5.6970 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0240 -4.8390 -5.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7630 -4.9170 -3.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5990 -5.2410 -3.2630 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7320 -5.4890 -3.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6910 -4.7240 -0.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8500 -5.5340 0.6900 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.0870 -5.2190 1.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0940 -7.0400 0.6230 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1850 -7.8620 0.5960 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.4210 -7.3270 0.6700 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.7280 -8.7240 0.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4480 -6.4920 0.1780 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2700 -7.1590 0.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4570 0.9900 -3.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1110 0.6590 -4.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1760 1.4320 -2.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9450 -1.3820 -2.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6690 -0.6160 -1.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1650 0.6050 -2.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1140 -0.7640 -1.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7220 -0.2460 -0.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0540 -2.1090 -4.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7090 -1.8910 -3.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7710 -0.4910 -4.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9420 -2.8550 -1.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8440 -4.9950 -0.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3030 -2.9800 -1.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8200 -4.1030 -2.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3120 -3.9560 -5.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5520 -4.4200 -6.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2550 -5.0440 -6.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6790 -3.6650 -0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7370 -5.0470 -0.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3470 -9.1760 -0.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3150 -9.2270 1.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8160 -8.8320 0.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4150 -7.3490 -0.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2220 -6.5960 1.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5710 -8.1280 1.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3630 -5.2010 0.5120 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.8030 -5.7600 1.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1980 -4.2140 0.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 36 1 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 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 41 1 0 0 0 0 5 42 1 0 0 0 0 5 43 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 44 1 0 0 0 0 8 9 1 0 0 0 0 8 45 1 0 0 0 0 9 10 2 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 11 46 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 59 1 0 0 0 0 14 15 2 0 0 0 0 14 22 1 0 0 0 0 15 16 1 0 0 0 0 15 24 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 47 1 0 0 0 0 18 19 1 0 0 0 0 18 48 1 0 0 0 0 19 20 2 0 0 0 0 19 49 1 0 0 0 0 20 21 1 0 0 0 0 20 50 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 24 25 1 0 0 0 0 24 51 1 0 0 0 0 24 52 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 59 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 29 30 1 0 0 0 0 30 53 1 0 0 0 0 30 54 1 0 0 0 0 30 55 1 0 0 0 0 31 32 1 0 0 0 0 32 56 1 0 0 0 0 32 57 1 0 0 0 0 32 58 1 0 0 0 0 59 60 1 0 0 0 0 59 61 1 0 0 0 0 M CHG 1 59 1 M END