IBS-ZINC04028975 MOE2007 3D CORINA 3.40 0006 02.08.2006 69 72 0 0 1 0 0 0 0 0999 V2000 -0.3460 1.1810 0.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0970 -0.2130 0.1310 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5900 -0.6480 -0.9730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0240 0.1710 -2.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7290 -0.3760 -3.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0100 -1.7490 -3.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5850 -2.5830 -2.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8600 -2.0260 -1.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4720 -2.8360 0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8330 -3.3580 -0.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8170 -3.9330 -2.0370 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5960 -4.5210 -3.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1680 0.5400 -4.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0200 1.7530 -4.1230 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7460 -0.1460 -5.1910 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2230 0.6730 -6.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9220 -0.2220 -7.3070 C 0 0 3 0 0 0 0 0 0 0 0 0 3.1710 -0.9400 -7.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0670 -1.0550 -6.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3190 -0.2240 -6.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8060 0.5720 -7.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4880 0.5290 -8.5160 C 0 0 3 0 0 0 0 0 0 0 0 0 4.8930 -0.2060 -9.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6060 1.4970 -9.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5260 2.6690 -9.7140 C 0 0 3 0 0 0 0 0 0 0 0 0 4.2540 3.5350 -9.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9340 2.2310 -9.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4020 3.0810 -11.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4210 4.1760 -11.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2750 4.6340 -13.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8560 5.0940 -13.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8370 4.0160 -12.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9730 3.5590 -11.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5900 1.7490 0.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9900 1.5350 -0.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8770 1.3480 1.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8260 1.2390 -2.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5630 -2.1550 -3.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1030 -3.9960 0.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5770 -2.5580 -0.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8510 -3.9740 -1.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6000 -4.0850 -3.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7040 -5.5860 -2.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0930 -4.4370 -4.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3590 1.1740 -6.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9070 1.4300 -5.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7300 -1.5650 -5.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3480 -1.8480 -7.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1040 0.4620 -5.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1200 -0.8880 -6.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6020 1.2700 -7.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1540 -0.0830 -8.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1780 0.9760 -10.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7660 1.8840 -8.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4250 1.6030 -10.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5800 3.0600 -9.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6160 2.2000 -11.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2940 5.0400 -10.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4440 3.8110 -11.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9780 5.4510 -13.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5460 3.8090 -13.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6350 6.0050 -12.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7720 5.3520 -14.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8240 4.3980 -13.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9700 3.1560 -13.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2480 2.7590 -11.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7010 4.3890 -10.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6580 1.3810 -8.0940 N 0 3 0 0 0 0 0 0 0 0 0 0 5.3710 2.0260 -7.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 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 37 1 0 0 0 0 5 6 1 0 0 0 0 5 13 1 0 0 0 0 6 7 2 0 0 0 0 6 38 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 39 1 0 0 0 0 10 40 1 0 0 0 0 10 41 1 0 0 0 0 11 12 1 0 0 0 0 12 42 1 0 0 0 0 12 43 1 0 0 0 0 12 44 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 45 1 0 0 0 0 16 46 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 22 1 0 0 0 0 19 20 1 0 0 0 0 19 47 1 0 0 0 0 19 48 1 0 0 0 0 20 21 1 0 0 0 0 20 49 1 0 0 0 0 20 50 1 0 0 0 0 21 51 1 0 0 0 0 21 52 1 0 0 0 0 21 68 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 68 1 0 0 0 0 24 25 1 0 0 0 0 24 53 1 0 0 0 0 24 54 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 28 1 0 0 0 0 27 55 1 0 0 0 0 27 56 1 0 0 0 0 27 68 1 0 0 0 0 28 29 1 0 0 0 0 28 33 1 0 0 0 0 28 57 1 0 0 0 0 29 30 1 0 0 0 0 29 58 1 0 0 0 0 29 59 1 0 0 0 0 30 31 1 0 0 0 0 30 60 1 0 0 0 0 30 61 1 0 0 0 0 31 32 1 0 0 0 0 31 62 1 0 0 0 0 31 63 1 0 0 0 0 32 33 1 0 0 0 0 32 64 1 0 0 0 0 32 65 1 0 0 0 0 33 66 1 0 0 0 0 33 67 1 0 0 0 0 68 69 1 0 0 0 0 M CHG 1 68 1 M END