NCID-ZINC05939650 MOE2007 3D CORINA 3.40 0006 02.08.2006 79 84 0 0 0 0 0 0 0 0999 V2000 2.6610 2.6450 -1.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8710 1.7320 -0.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0750 -0.6590 -0.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3860 -1.4140 -0.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0240 0.9990 -2.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3100 0.1140 -3.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4260 0.6000 -4.1560 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2880 1.7230 -4.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2440 2.3730 -4.9590 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4410 2.0930 -5.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5980 3.2610 -6.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8660 3.2380 -7.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5590 4.1280 -7.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8370 3.7900 -8.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4100 2.5740 -8.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7390 1.6750 -7.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4680 2.0360 -6.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5870 1.3580 -5.9580 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7770 0.4400 -5.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4670 4.7310 -9.2950 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.6890 4.5930 -9.9380 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3590 3.5660 -9.9550 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.1290 5.7780 -10.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0510 5.8220 -11.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2090 7.1690 -12.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9820 7.8070 -13.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9160 9.2040 -13.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0710 9.9420 -12.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2930 9.3280 -11.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3860 7.9410 -11.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7660 7.0860 -10.4160 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.1390 7.3990 -9.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7270 9.7740 -14.2650 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.8840 11.1220 -14.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4290 12.0390 -13.8810 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.6940 11.3840 -15.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.4120 12.5360 -16.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.0660 12.3740 -17.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.9310 13.1810 -18.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.3990 12.6830 -19.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.0210 11.4180 -19.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.1600 10.6140 -18.9810 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.7050 11.1190 -17.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.8560 10.5570 -16.8290 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.4130 9.6580 -16.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.3040 13.5060 -20.0790 N 0 3 0 0 0 0 0 0 0 0 0 0 -15.5920 14.6350 -19.6580 O 0 0 0 0 0 0 0 0 0 0 0 0 -15.7310 13.0240 -21.1390 O 0 5 0 0 0 0 0 0 0 0 0 0 3.4620 2.0960 -2.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0300 3.1080 -2.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1220 3.4510 -0.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5420 1.3140 0.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0540 2.2560 -0.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3390 -1.3030 -1.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6750 -0.3380 0.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7740 -1.7090 -1.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1530 -0.8220 0.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2310 -2.3260 0.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0930 2.0430 -2.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8330 0.9510 -1.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5720 0.0680 -4.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5600 -0.9070 -3.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2980 0.0930 -4.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8640 4.0550 -6.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0840 5.0640 -8.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3990 2.2820 -8.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1990 0.7330 -6.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9420 5.5790 -9.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5520 4.9570 -12.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6280 7.2020 -13.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9840 11.0210 -12.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6480 9.9200 -10.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2610 9.1140 -14.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.4700 13.4020 -15.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.2170 14.1620 -17.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.3830 11.0360 -20.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.8590 9.6340 -19.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2680 0.5780 -1.4380 N 0 3 0 0 0 0 0 0 0 0 0 0 1.9480 0.3400 -2.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 49 1 0 0 0 0 1 50 1 0 0 0 0 1 51 1 0 0 0 0 2 52 1 0 0 0 0 2 53 1 0 0 0 0 2 78 1 0 0 0 0 3 4 1 0 0 0 0 3 54 1 0 0 0 0 3 55 1 0 0 0 0 3 78 1 0 0 0 0 4 56 1 0 0 0 0 4 57 1 0 0 0 0 4 58 1 0 0 0 0 5 6 1 0 0 0 0 5 59 1 0 0 0 0 5 60 1 0 0 0 0 5 78 1 0 0 0 0 6 7 1 0 0 0 0 6 61 1 0 0 0 0 6 62 1 0 0 0 0 7 8 1 0 0 0 0 7 63 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 2 0 0 0 0 10 18 1 0 0 0 0 11 12 1 0 0 0 0 11 64 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 65 1 0 0 0 0 14 15 1 0 0 0 0 14 20 1 0 0 0 0 15 16 2 0 0 0 0 15 66 1 0 0 0 0 16 17 1 0 0 0 0 16 67 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 20 21 1 0 0 0 0 20 68 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 2 0 0 0 0 23 31 1 0 0 0 0 24 25 1 0 0 0 0 24 69 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 70 1 0 0 0 0 27 28 1 0 0 0 0 27 33 1 0 0 0 0 28 29 2 0 0 0 0 28 71 1 0 0 0 0 29 30 1 0 0 0 0 29 72 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 33 34 1 0 0 0 0 33 73 1 0 0 0 0 34 35 2 0 0 0 0 34 36 1 0 0 0 0 36 37 2 0 0 0 0 36 44 1 0 0 0 0 37 38 1 0 0 0 0 37 74 1 0 0 0 0 38 39 1 0 0 0 0 38 43 2 0 0 0 0 39 40 2 0 0 0 0 39 75 1 0 0 0 0 40 41 1 0 0 0 0 40 46 1 0 0 0 0 41 42 2 0 0 0 0 41 76 1 0 0 0 0 42 43 1 0 0 0 0 42 77 1 0 0 0 0 43 44 1 0 0 0 0 44 45 1 0 0 0 0 46 47 2 0 0 0 0 46 48 1 0 0 0 0 78 79 1 0 0 0 0 M CHG 1 46 1 M CHG 1 48 -1 M CHG 1 78 1 M END