ANALYTICONDISCOVERY-ZINC05398730 MOE2007 3D CORINA 3.40 0006 02.08.2006 72 77 0 0 1 0 0 0 0 0999 V2000 -0.5690 1.4580 1.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5660 0.0300 1.5160 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4880 -0.6200 0.7590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5410 -2.0060 0.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4840 -2.6700 -0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3730 -1.9460 -0.7870 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3190 -0.5600 -0.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3810 0.1020 -0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1900 0.1490 -1.5620 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0780 1.5730 -1.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5370 -4.0670 0.0040 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7240 -4.6960 0.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1750 -3.7870 0.1330 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.7690 -6.0400 0.2080 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.0600 -6.7230 0.3270 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.7590 -6.1160 0.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6380 -7.0340 -1.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2790 -8.3180 -0.9270 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3940 -9.1030 -0.1010 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.5880 -9.5660 -0.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8790 -8.1080 0.9830 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.8480 -8.3020 1.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8170 -8.2300 2.0720 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1160 -9.6390 2.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2340 -10.1310 0.6870 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.2730 -10.1090 0.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6740 -11.4760 0.5340 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.4870 -12.5860 0.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7700 -12.4120 0.9730 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.5790 -13.4470 1.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0750 -14.7280 0.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7190 -14.8800 0.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9650 -13.7920 0.5400 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.1300 -16.2310 0.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7750 -16.3700 0.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2280 -17.6260 0.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0290 -18.7580 0.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3830 -18.6180 0.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9300 -17.3630 0.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4400 -20.1090 0.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2380 -21.2420 0.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6840 -22.4980 0.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3400 -22.6330 -0.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5440 -21.5120 -0.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0880 -20.2520 -0.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2150 1.8490 2.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3860 1.7800 0.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5370 1.8330 1.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8490 -2.5680 1.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1060 -2.4620 -1.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3420 1.1820 -0.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2340 1.9210 -0.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0840 1.8680 -1.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8290 2.0140 -2.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7200 -4.5840 -0.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9470 -6.5540 0.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3670 -6.2750 -1.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8370 -7.0890 -1.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3080 -10.1650 2.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0580 -9.7910 2.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7340 -11.5880 0.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6230 -13.2940 1.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7140 -15.5900 1.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1550 -15.4940 0.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1790 -17.7340 -0.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0030 -19.4950 0.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9780 -17.2560 0.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2870 -21.1380 0.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3010 -23.3760 0.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9120 -23.6170 -0.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4950 -21.6230 -0.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4660 -19.3770 -0.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 46 1 0 0 0 0 1 47 1 0 0 0 0 1 48 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 49 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 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 9 1 0 0 0 0 8 51 1 0 0 0 0 9 10 1 0 0 0 0 10 52 1 0 0 0 0 10 53 1 0 0 0 0 10 54 1 0 0 0 0 11 12 1 0 0 0 0 11 55 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 56 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 21 1 0 0 0 0 17 18 1 0 0 0 0 17 57 1 0 0 0 0 17 58 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 25 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 59 1 0 0 0 0 24 60 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 27 61 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 30 62 1 0 0 0 0 31 32 2 0 0 0 0 31 63 1 0 0 0 0 32 33 1 0 0 0 0 32 34 1 0 0 0 0 34 35 1 0 0 0 0 34 39 2 0 0 0 0 35 36 2 0 0 0 0 35 64 1 0 0 0 0 36 37 1 0 0 0 0 36 65 1 0 0 0 0 37 38 2 0 0 0 0 37 40 1 0 0 0 0 38 39 1 0 0 0 0 38 66 1 0 0 0 0 39 67 1 0 0 0 0 40 41 1 0 0 0 0 40 45 2 0 0 0 0 41 42 2 0 0 0 0 41 68 1 0 0 0 0 42 43 1 0 0 0 0 42 69 1 0 0 0 0 43 44 2 0 0 0 0 43 70 1 0 0 0 0 44 45 1 0 0 0 0 44 71 1 0 0 0 0 45 72 1 0 0 0 0 M END