PUBCHEM-ZINC04830719 MOE2007 3D CORINA 3.40 0006 02.08.2006 73 77 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6060 -0.6070 -1.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6610 -1.9920 -1.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2750 -2.6020 -2.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8350 -1.8350 -3.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7820 -0.4550 -3.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1630 0.1610 -2.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5040 -2.5030 -4.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4750 -2.7430 -5.4880 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6350 -3.3090 -5.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1140 -3.5200 -6.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1660 -3.0450 -7.7240 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6290 -4.7430 -6.3740 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2510 -5.4990 -7.4640 C 0 0 3 0 0 0 0 0 0 0 0 0 3.7560 -4.8240 -8.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1940 -6.3450 -8.2080 C 0 0 3 0 0 0 0 0 0 0 0 0 2.4430 -6.4180 -9.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2580 -7.6470 -7.5850 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6650 -7.8980 -7.3730 C 0 0 3 0 0 0 0 0 0 0 0 0 4.1390 -8.2090 -8.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2440 -6.5420 -6.9020 C 0 0 3 0 0 0 0 0 0 0 0 0 5.2390 -6.3840 -7.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2810 -6.4800 -5.4750 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8500 -8.9200 -6.3410 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9630 -9.2460 -5.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4500 -10.1970 -4.6160 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6780 -10.5420 -5.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9470 -9.7310 -6.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1010 -9.8790 -6.8310 N 0 0 0 0 0 0 0 0 0 0 0 0 6.9810 -10.7730 -6.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7710 -11.5590 -5.3920 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6500 -11.4780 -4.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4390 -12.3070 -3.5950 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8020 -5.7350 -8.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1420 -6.4630 -8.8180 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9970 -1.4550 -5.9970 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0130 -0.8170 -5.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5270 -1.3100 -4.3890 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4530 0.3670 -5.8420 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5440 0.9970 -5.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8980 2.3020 -5.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8500 2.3320 -6.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1740 3.5300 -7.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5470 4.6980 -7.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5960 4.6680 -6.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2740 3.4710 -5.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2240 -2.5910 -0.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3190 -3.6800 -2.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2200 0.1420 -3.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1170 1.2380 -2.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3010 -1.8620 -4.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9250 -3.4570 -4.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5880 -5.1230 -5.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8880 -7.1140 -5.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9980 -8.7820 -5.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9090 -10.8680 -6.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6110 -12.2460 -3.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1180 -12.9490 -3.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5150 -5.7870 -6.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8180 -4.6940 -8.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0470 -6.1310 -8.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4070 -1.0620 -6.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4120 0.3380 -5.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2380 1.1840 -4.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3400 1.4200 -7.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9180 3.5530 -8.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8000 5.6330 -7.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1060 5.5800 -5.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5340 3.4480 -4.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 48 1 0 0 0 0 1 49 1 0 0 0 0 1 50 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 51 1 0 0 0 0 5 6 1 0 0 0 0 5 52 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 53 1 0 0 0 0 8 54 1 0 0 0 0 9 10 1 0 0 0 0 9 55 1 0 0 0 0 9 56 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 37 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 57 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 22 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 35 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 25 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 24 58 1 0 0 0 0 25 26 1 0 0 0 0 25 29 1 0 0 0 0 26 27 2 0 0 0 0 26 59 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 28 33 2 0 0 0 0 29 30 2 0 0 0 0 30 31 1 0 0 0 0 31 32 2 0 0 0 0 31 60 1 0 0 0 0 32 33 1 0 0 0 0 33 34 1 0 0 0 0 34 61 1 0 0 0 0 34 62 1 0 0 0 0 35 36 1 0 0 0 0 35 63 1 0 0 0 0 35 64 1 0 0 0 0 36 65 1 0 0 0 0 37 38 1 0 0 0 0 37 66 1 0 0 0 0 38 39 2 0 0 0 0 38 40 1 0 0 0 0 40 41 1 0 0 0 0 41 42 1 0 0 0 0 41 67 1 0 0 0 0 41 68 1 0 0 0 0 42 43 1 0 0 0 0 42 47 2 0 0 0 0 43 44 2 0 0 0 0 43 69 1 0 0 0 0 44 45 1 0 0 0 0 44 70 1 0 0 0 0 45 46 2 0 0 0 0 45 71 1 0 0 0 0 46 47 1 0 0 0 0 46 72 1 0 0 0 0 47 73 1 0 0 0 0 M END