PUBCHEM-ZINC04586978 MOE2007 3D CORINA 3.40 0006 02.08.2006 71 75 0 0 1 0 0 0 0 0999 V2000 -2.2900 1.4140 -1.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6550 0.0520 -1.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9580 0.1590 0.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8100 -0.9650 -0.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6230 -0.3340 -2.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4850 0.4980 -2.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4410 0.1780 -3.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3220 -0.9880 -4.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2250 -1.8240 -3.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7300 -1.5020 -2.9910 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3690 -1.3160 -5.2500 C 0 0 3 0 0 0 0 0 0 0 0 0 3.0840 -0.4800 -5.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1690 -2.5710 -4.8830 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0600 -3.1230 -5.9960 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9190 -2.7240 -7.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6880 -3.2490 -8.4740 C 0 0 3 0 0 0 0 0 0 0 0 0 4.0390 -3.0910 -9.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8490 -4.7140 -8.3570 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8960 -5.1830 -7.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8790 -6.0220 -8.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9220 -6.5090 -7.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9940 -6.1610 -5.9530 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0220 -5.3260 -5.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9530 -4.8240 -6.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0140 -4.0020 -5.5100 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9660 -5.5660 -9.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1680 -5.1490 -9.8770 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9960 -7.0480 -8.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6900 -7.7740 -8.9670 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6680 -9.2240 -8.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7720 -9.7020 -8.0900 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9850 -2.5190 -8.8300 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4730 -2.6070 -10.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6600 -1.9650 -10.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3950 -1.2520 -9.5870 N 0 0 0 0 0 0 0 0 0 0 0 0 7.9160 -1.1840 -8.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7400 -1.7890 -7.9050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8910 -1.6910 -7.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9550 -1.0430 -8.6550 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7660 -1.4710 -6.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5520 2.2230 -1.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7680 1.3810 -2.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0550 1.6960 -0.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6790 0.3980 1.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4690 -0.7850 0.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1930 0.9420 0.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3800 -1.0700 -1.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4400 -1.9560 -0.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5160 -0.6470 -0.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6210 1.4180 -1.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2790 0.8550 -3.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0960 -2.7450 -4.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5570 -2.1940 -2.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7840 -2.3340 -4.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4980 -3.3850 -4.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8470 -6.2830 -9.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6760 -7.1560 -7.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8030 -6.5400 -5.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1050 -5.0710 -4.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0480 -4.0790 -4.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8140 -7.5210 -9.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1970 -7.1470 -7.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8520 -7.2380 -8.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5140 -7.7790 -10.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9380 -3.1700 -10.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0630 -2.0130 -11.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5250 -0.6110 -7.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4410 -1.6900 -6.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0690 -2.3130 -6.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2240 -0.5620 -6.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5300 -9.7750 -8.5160 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 41 1 0 0 0 0 1 42 1 0 0 0 0 1 43 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 5 1 0 0 0 0 3 44 1 0 0 0 0 3 45 1 0 0 0 0 3 46 1 0 0 0 0 4 47 1 0 0 0 0 4 48 1 0 0 0 0 4 49 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 50 1 0 0 0 0 7 8 1 0 0 0 0 7 51 1 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 52 1 0 0 0 0 10 53 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 40 1 0 0 0 0 13 14 1 0 0 0 0 13 54 1 0 0 0 0 13 55 1 0 0 0 0 14 15 2 0 0 0 0 14 25 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 32 1 0 0 0 0 18 19 1 0 0 0 0 18 26 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 56 1 0 0 0 0 21 22 1 0 0 0 0 21 57 1 0 0 0 0 22 23 2 0 0 0 0 22 58 1 0 0 0 0 23 24 1 0 0 0 0 23 59 1 0 0 0 0 24 25 1 0 0 0 0 25 60 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 29 1 0 0 0 0 28 61 1 0 0 0 0 28 62 1 0 0 0 0 29 30 1 0 0 0 0 29 63 1 0 0 0 0 29 64 1 0 0 0 0 30 31 2 0 0 0 0 30 71 1 0 0 0 0 32 33 1 0 0 0 0 32 37 2 0 0 0 0 33 34 2 0 0 0 0 33 65 1 0 0 0 0 34 35 1 0 0 0 0 34 66 1 0 0 0 0 35 36 2 0 0 0 0 36 37 1 0 0 0 0 36 67 1 0 0 0 0 37 68 1 0 0 0 0 38 39 2 0 0 0 0 38 40 1 0 0 0 0 40 69 1 0 0 0 0 40 70 1 0 0 0 0 M CHG 1 71 -1 M END