PUBCHEM-ZINC03166581 MOE2007 3D CORINA 3.40 0006 02.08.2006 60 62 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.6990 1.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -2.0790 1.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7730 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0660 -1.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6860 -1.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -4.2540 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0790 -4.9260 1.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0560 -4.9450 -1.2340 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0750 -6.3460 -1.2410 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0730 -7.0130 -2.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0540 -6.4010 -3.4590 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0930 -8.5200 -2.4200 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9930 -8.8740 -1.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1420 -9.0510 -1.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0600 -10.5520 -1.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4470 -11.1390 -0.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3710 -12.5160 -0.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9100 -13.3090 -1.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5240 -12.7170 -2.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6030 -11.3400 -2.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8360 -14.6630 -1.3190 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0860 -9.0010 -3.8040 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5930 -10.2140 -4.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0560 -10.9100 -3.2160 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5860 -10.7000 -5.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1100 -11.9560 -5.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1000 -12.4030 -7.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5720 -11.6090 -8.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0510 -10.3620 -7.8120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0500 -9.9060 -6.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5120 -9.5200 -8.8910 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.5160 -9.9230 -10.0400 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9710 -8.4220 -8.6290 O 0 5 0 0 0 0 0 0 0 0 0 0 1.6560 -13.7350 -7.4370 N 0 3 0 0 0 0 0 0 0 0 0 0 2.1210 -14.4350 -6.5560 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6470 -14.1310 -8.5890 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1610 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -2.6210 2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.5980 -2.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0270 -0.1380 -2.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0940 -6.0060 1.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0810 -4.3920 2.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -4.4550 -2.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0900 -6.8350 -0.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1840 -8.6220 -0.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0390 -8.7720 -2.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0270 -10.5220 0.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1090 -12.9740 0.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9450 -13.3320 -3.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0860 -10.8800 -3.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5870 -15.0690 -0.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2830 -8.4460 -4.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5230 -12.5770 -5.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5670 -11.9630 -9.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3620 -8.9350 -6.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 39 1 0 0 0 0 1 40 1 0 0 0 0 1 41 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 42 1 0 0 0 0 4 5 1 0 0 0 0 4 43 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 44 1 0 0 0 0 7 45 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 9 46 1 0 0 0 0 9 47 1 0 0 0 0 10 11 1 0 0 0 0 10 48 1 0 0 0 0 11 12 1 0 0 0 0 11 49 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 24 1 0 0 0 0 16 17 1 0 0 0 0 16 50 1 0 0 0 0 16 51 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 52 1 0 0 0 0 19 20 1 0 0 0 0 19 53 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 54 1 0 0 0 0 22 55 1 0 0 0 0 23 56 1 0 0 0 0 24 25 1 0 0 0 0 24 57 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 28 58 1 0 0 0 0 29 30 1 0 0 0 0 29 36 1 0 0 0 0 30 31 2 0 0 0 0 30 59 1 0 0 0 0 31 32 1 0 0 0 0 31 33 1 0 0 0 0 32 60 1 0 0 0 0 33 34 2 0 0 0 0 33 35 1 0 0 0 0 36 37 2 0 0 0 0 36 38 1 0 0 0 0 M CHG 1 33 1 M CHG 1 35 -1 M CHG 1 36 1 M CHG 1 38 -1 M END