PUBCHEM-ZINC06044667 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 53 0 0 0 0 0 0 0 0999 V2000 0.0600 1.6050 -0.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 0.1130 -0.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1590 -0.4670 1.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1730 -1.8550 1.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1020 -2.6510 0.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0860 -4.0740 0.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 -4.7720 -1.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0370 -4.0810 -2.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 -2.6870 -2.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0470 -1.9590 -1.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 -0.6180 -1.2230 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0490 -4.8610 1.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9660 -5.0310 2.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5000 -5.9850 3.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0750 -6.5790 4.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3360 -7.5180 5.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9660 -7.8520 4.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5570 -7.2690 3.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7950 -6.3480 2.8620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1030 -5.6530 1.7170 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9830 -5.7190 1.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9380 -8.1420 6.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4440 -8.6440 7.1540 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3130 -4.3780 2.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3270 -5.1500 1.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6610 -4.4080 1.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6660 -5.1650 0.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9820 2.0340 0.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0200 1.8960 -1.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7970 2.0260 0.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2140 0.1400 2.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2450 -2.3120 2.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0450 -5.8600 -1.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0210 -4.6210 -3.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 -2.1520 -3.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0870 -6.3170 4.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5390 -8.5790 5.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5670 -7.5340 3.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6830 -4.2890 3.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2290 -3.3520 1.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9390 -5.2910 0.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4780 -6.1520 1.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0590 -4.2740 2.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5010 -3.4060 0.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3100 -5.3080 -0.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9300 -6.1330 0.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9140 -4.3720 0.4080 N 0 3 0 0 0 0 0 0 0 0 0 0 -7.6120 -4.8500 -0.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7520 -3.4470 -0.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3390 -4.2230 1.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 11 2 0 0 0 0 3 4 2 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 12 1 0 0 0 0 7 8 1 0 0 0 0 7 33 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 1 0 0 0 0 12 13 2 0 0 0 0 12 20 1 0 0 0 0 13 14 1 0 0 0 0 13 24 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 22 1 0 0 0 0 17 18 2 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 22 23 3 0 0 0 0 24 25 1 0 0 0 0 24 39 1 0 0 0 0 24 40 1 0 0 0 0 25 26 1 0 0 0 0 25 41 1 0 0 0 0 25 42 1 0 0 0 0 26 27 1 0 0 0 0 26 43 1 0 0 0 0 26 44 1 0 0 0 0 27 45 1 0 0 0 0 27 46 1 0 0 0 0 27 47 1 0 0 0 0 47 48 1 0 0 0 0 47 49 1 0 0 0 0 47 50 1 0 0 0 0 M CHG 1 47 1 M END