NCID-ZINC04919136 MOE2007 3D CORINA 3.40 0006 02.08.2006 76 76 0 0 1 0 0 0 0 0999 V2000 0.5660 1.2740 -0.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4550 -0.2500 -0.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6860 -0.8830 0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8040 -0.7060 0.1350 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.7780 -0.3350 1.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8620 -2.2120 0.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2730 -2.8100 -0.8250 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4570 -2.8930 1.2360 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1660 -2.3040 2.4350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9770 -3.4610 3.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0470 -4.6750 2.8050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5700 -4.3460 1.4290 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.0220 -4.8680 0.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0200 -4.7560 1.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8830 -3.9200 1.2410 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3570 -6.0510 1.5630 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3140 -7.0610 1.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7670 -6.4490 1.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1720 -6.7780 0.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3620 -6.6890 -0.7740 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4330 -7.1710 -0.1410 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.4110 -7.2790 0.9450 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8260 -7.4910 -1.5150 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.9510 -7.4470 -2.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4230 -8.9000 -1.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6560 -9.3080 -3.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4550 -9.8850 -0.9030 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8540 -6.4950 -1.9890 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2190 -5.6090 -1.2540 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9890 -0.1770 -0.5460 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4300 1.0650 -0.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8460 1.7450 0.5530 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6480 1.6090 -0.9640 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.6280 1.3120 -2.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9090 1.0520 -0.3000 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.9290 1.3500 0.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1460 1.6040 -1.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9050 -0.3740 -0.3910 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4640 1.6000 -1.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3110 1.7260 -0.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6260 1.5840 0.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3960 -0.5590 -1.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7890 -0.5140 1.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5710 -1.9670 0.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5760 -0.6210 -0.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8290 -1.4850 2.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5990 -1.9530 3.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9360 -3.5870 2.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1150 -3.3010 4.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6230 -5.5990 2.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7300 -4.7390 3.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1130 -7.1720 2.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6500 -8.0140 1.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4040 -6.7470 1.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9080 -7.3260 2.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3820 -5.6300 1.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9710 -6.3470 1.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0970 -8.0990 0.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8920 -7.4700 1.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3720 -8.9090 -1.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7110 -9.2790 -3.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0630 -10.3190 -3.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3610 -8.6180 -3.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5060 -9.8750 -1.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2890 -9.5940 0.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8800 -10.8880 -0.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4560 -0.7210 -1.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0450 1.2080 -0.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1500 2.6920 -0.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1260 1.3070 -2.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6770 -0.7960 0.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4250 3.4680 -1.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3620 -6.5930 -3.2270 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6530 3.0750 -0.8720 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6710 3.3760 0.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0180 -5.9310 -3.4860 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 4 1 0 0 0 0 2 42 1 0 0 0 0 3 43 1 0 0 0 0 3 44 1 0 0 0 0 3 45 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 30 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 12 1 0 0 0 0 9 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 10 49 1 0 0 0 0 11 12 1 0 0 0 0 11 50 1 0 0 0 0 11 51 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 17 52 1 0 0 0 0 17 53 1 0 0 0 0 17 54 1 0 0 0 0 18 19 1 0 0 0 0 18 55 1 0 0 0 0 18 56 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 57 1 0 0 0 0 22 58 1 0 0 0 0 22 59 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 28 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 60 1 0 0 0 0 26 61 1 0 0 0 0 26 62 1 0 0 0 0 26 63 1 0 0 0 0 27 64 1 0 0 0 0 27 65 1 0 0 0 0 27 66 1 0 0 0 0 28 29 2 0 0 0 0 28 73 1 0 0 0 0 30 31 1 0 0 0 0 30 67 1 0 0 0 0 31 32 2 0 0 0 0 31 33 1 0 0 0 0 33 34 1 0 0 0 0 33 35 1 0 0 0 0 33 74 1 0 0 0 0 35 36 1 0 0 0 0 35 37 1 0 0 0 0 35 38 1 0 0 0 0 37 68 1 0 0 0 0 37 69 1 0 0 0 0 37 70 1 0 0 0 0 38 71 1 0 0 0 0 72 74 1 0 0 0 0 73 76 1 0 0 0 0 74 75 1 0 0 0 0 M END