PUBCHEM-ZINC03870151 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 58 0 0 1 0 0 0 0 0999 V2000 -0.2980 1.2540 -0.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3890 -0.0750 -0.4050 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7010 -0.7930 -0.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9730 -2.2080 -0.5110 N 0 3 0 0 0 0 0 0 0 0 0 0 2.3820 -2.3430 -0.9450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8600 -1.1620 -1.2390 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9500 -0.2340 -1.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0580 1.1240 -1.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8810 1.8940 -1.1030 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8780 3.3470 -1.3390 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6590 3.7630 -0.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0670 3.7120 -2.8200 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9180 2.8490 -3.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0060 4.7710 -3.0610 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.3090 4.8270 -4.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0910 4.3120 -2.1140 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.5530 3.3970 -2.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3790 3.9140 -0.9170 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1390 5.3680 -1.7830 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3590 4.7270 -1.4240 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4220 4.4620 -2.6580 P 0 0 0 0 0 0 0 0 0 0 0 0 -3.5750 3.7450 -3.7050 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5910 6.0320 -2.7010 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0810 6.7170 -2.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 4.2500 -3.0550 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2440 5.2220 -2.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2200 1.6860 -1.8330 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0540 -3.2260 -0.0780 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9630 -2.8720 -0.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1700 -3.6600 1.4100 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8240 -4.0510 1.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0750 -4.8960 1.2850 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9590 -5.6030 2.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6530 -5.4990 -0.0500 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2610 -6.0920 0.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2770 -4.3890 -0.8960 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7290 -6.3410 -0.7260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1570 -7.0110 -1.8450 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9470 -8.3510 -2.3740 P 0 0 0 0 0 0 0 0 0 0 0 0 1.8130 -9.3240 -1.2090 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4360 -4.4460 1.2900 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3290 -3.6320 1.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7680 -2.7600 2.1880 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.2200 1.8030 -0.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9390 -3.2710 -1.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8280 5.9770 -0.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3140 6.0350 -2.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0800 1.1530 -1.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2370 2.6560 -2.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5440 -5.7130 -1.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1320 -7.0720 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5090 3.6050 -2.0240 O 0 5 0 0 0 0 0 0 0 0 0 0 -4.8590 5.8630 -3.0610 O 0 5 0 0 0 0 0 0 0 0 0 0 1.1810 -8.7580 -3.6260 O 0 5 0 0 0 0 0 0 0 0 0 0 3.3710 -7.8720 -2.6340 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 9 1 0 0 0 0 1 44 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 7 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 5 6 2 0 0 0 0 5 45 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 8 27 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 18 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 25 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 23 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 19 1 0 0 0 0 19 20 1 0 0 0 0 19 46 1 0 0 0 0 19 47 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 52 1 0 0 0 0 21 53 1 0 0 0 0 23 24 1 0 0 0 0 25 26 1 0 0 0 0 27 48 1 0 0 0 0 27 49 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 28 36 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 30 43 1 0 0 0 0 32 33 1 0 0 0 0 32 34 1 0 0 0 0 32 41 1 0 0 0 0 34 35 1 0 0 0 0 34 36 1 0 0 0 0 34 37 1 0 0 0 0 37 38 1 0 0 0 0 37 50 1 0 0 0 0 37 51 1 0 0 0 0 38 39 1 0 0 0 0 39 40 2 0 0 0 0 39 54 1 0 0 0 0 39 55 1 0 0 0 0 41 42 1 0 0 0 0 M CHG 1 4 1 M CHG 1 43 -1 M CHG 1 52 -1 M CHG 1 53 -1 M CHG 1 54 -1 M CHG 1 55 -1 M END