PUBCHEM-ZINC06016570 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 49 0 0 0 0 0 0 0 0999 V2000 -0.2670 1.4630 -0.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.0410 0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6870 -0.4930 -1.1980 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0520 -0.6500 -1.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1450 -0.4590 -0.5250 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4180 -0.7120 -0.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6140 -1.1550 -2.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5420 -1.3500 -3.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2440 -1.1000 -2.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0200 -1.1960 -3.2500 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0970 -0.8450 -2.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2440 -0.8300 -2.6280 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.8400 -1.2690 -3.7260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2190 -1.0730 -3.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4310 -0.5080 -2.3630 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2340 -0.3530 -1.7580 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0850 0.0240 -0.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7700 -0.1240 -1.7870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2070 -1.8260 -4.8370 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9360 -2.2340 -5.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1460 -2.1160 -5.8800 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2650 -2.8250 -7.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0180 -3.2480 -8.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3850 -3.7980 -9.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0080 -3.9310 -9.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7440 -3.5130 -8.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1240 -2.9560 -7.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6800 1.9940 -0.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8920 1.6660 -0.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7780 1.7990 0.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6250 -0.2440 0.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9460 -0.5720 0.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -0.1140 0.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2680 -0.5630 -0.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6150 -1.3490 -2.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7010 -1.6950 -4.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9790 -1.3280 -4.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1790 -0.9650 -1.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6470 0.7300 -1.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4510 0.1410 -2.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2420 -1.9200 -4.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0930 -3.1460 -8.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9660 -4.1270 -10.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4820 -4.3620 -10.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8180 -3.6190 -8.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7120 -2.6270 -6.2500 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 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 11 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 2 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 13 19 1 0 0 0 0 14 15 2 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 25 26 2 0 0 0 0 25 44 1 0 0 0 0 26 27 1 0 0 0 0 26 45 1 0 0 0 0 27 46 1 0 0 0 0 M CHG 1 12 1 M END