NCID-ZINC05883011 MOE2007 3D CORINA 3.40 0006 02.08.2006 83 84 0 0 1 0 0 0 0 0999 V2000 -4.0880 1.2070 -1.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6200 1.5920 -1.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7400 0.6030 -0.5280 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.8080 -0.3690 -1.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2720 1.0400 -0.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1190 0.4070 0.9660 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.2540 0.0050 1.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2500 -0.6200 1.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3630 -0.2940 1.5640 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8910 -1.9050 0.8380 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7470 -3.0990 0.9480 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.1470 -3.1260 1.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8980 -3.0860 -0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4350 -2.7980 -1.3760 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6910 -2.1800 -1.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8910 -4.3770 0.7260 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6830 -4.1140 0.4190 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5280 1.6380 1.6400 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6400 2.5050 2.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4260 2.3060 2.3020 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2560 3.7670 2.8470 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.9170 3.4820 3.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9910 4.6540 1.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0380 5.8000 1.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3910 6.0630 2.8870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9000 4.5530 4.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5890 4.8050 5.2200 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8990 5.7350 4.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8200 4.9640 6.7390 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2960 5.0500 7.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0790 6.1130 6.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4550 6.1380 6.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0600 5.1080 7.5430 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2910 4.0620 8.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9140 4.0330 7.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4520 3.7310 4.6970 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9300 3.7240 3.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4850 4.4870 2.5480 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1190 2.7890 3.1780 C 0 0 3 0 0 0 0 0 0 0 0 0 3.1040 1.9700 3.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1540 2.2320 1.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4160 1.4310 1.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4520 1.7340 2.1500 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3420 0.3990 0.6740 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1850 -0.1370 0.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4940 0.1250 0.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5970 1.8570 -2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2070 0.1740 -1.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5990 1.3280 -0.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2300 1.6550 -2.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5370 2.6020 -0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1160 2.0560 -0.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3930 0.3620 -0.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 1.0260 -1.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9460 -2.1610 0.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4360 -4.0390 -0.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6210 -2.3070 0.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5340 1.8010 1.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2870 4.1370 0.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9040 5.0480 2.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2850 5.4880 0.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5540 6.6800 1.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4390 6.5940 2.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0750 6.5700 3.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1760 3.5330 5.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5650 5.2620 5.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3130 5.8640 7.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3730 4.1130 7.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6240 6.9280 6.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0550 6.9670 6.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1300 5.1340 7.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7640 3.2760 8.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3320 3.2100 8.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7020 2.9780 5.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2750 1.6030 1.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1430 3.0350 1.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4690 -5.4800 0.9100 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.1440 4.6730 3.4080 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.2680 4.3500 2.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3920 3.5540 3.4660 N 0 3 0 0 0 0 0 0 0 0 0 0 5.2090 2.9570 3.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5080 3.7930 4.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4660 4.4230 2.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 47 1 0 0 0 0 1 48 1 0 0 0 0 1 49 1 0 0 0 0 2 3 1 0 0 0 0 2 50 1 0 0 0 0 2 51 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 52 1 0 0 0 0 5 53 1 0 0 0 0 5 54 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 18 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 55 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 16 1 0 0 0 0 13 14 1 0 0 0 0 13 56 1 0 0 0 0 13 57 1 0 0 0 0 14 15 1 0 0 0 0 16 17 2 0 0 0 0 16 77 1 0 0 0 0 18 19 1 0 0 0 0 18 58 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 21 78 1 0 0 0 0 23 24 1 0 0 0 0 23 59 1 0 0 0 0 23 60 1 0 0 0 0 24 25 1 0 0 0 0 24 61 1 0 0 0 0 24 62 1 0 0 0 0 25 63 1 0 0 0 0 25 64 1 0 0 0 0 25 78 1 0 0 0 0 26 27 1 0 0 0 0 26 65 1 0 0 0 0 26 66 1 0 0 0 0 26 78 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 27 36 1 0 0 0 0 29 30 1 0 0 0 0 29 67 1 0 0 0 0 29 68 1 0 0 0 0 30 31 1 0 0 0 0 30 35 2 0 0 0 0 31 32 2 0 0 0 0 31 69 1 0 0 0 0 32 33 1 0 0 0 0 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