NCID-ZINC05371095 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 1 0 0 0 0 0999 V2000 1.0200 0.2850 1.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1800 0.1840 1.0710 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2510 1.0930 -0.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2010 1.5210 -0.2500 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2690 2.6160 -0.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8730 1.0300 0.9670 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2500 1.2450 1.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9400 1.4830 2.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3710 1.6830 3.4180 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3060 1.5760 2.2610 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8010 1.6810 3.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9790 1.5730 1.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3750 1.4570 -0.0630 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0120 1.2850 -0.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3630 1.1160 -1.2990 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9290 0.8890 -1.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3250 1.7140 1.1420 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2380 -0.7110 1.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5750 -0.3280 1.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6170 -1.2530 1.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3280 -2.5850 1.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0150 -2.9840 1.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9830 -2.0510 1.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4220 -3.5700 1.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4830 -3.2870 2.0110 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1320 -4.7420 0.8180 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.9750 -5.9450 0.8110 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.0150 -5.6520 0.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4960 -6.9490 1.8750 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6320 -6.4290 3.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1940 -7.4040 4.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4760 -8.3780 4.0450 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8680 -6.6800 -0.5610 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8250 -6.3890 -1.2290 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6480 0.6160 -0.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8740 1.9610 0.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9760 1.1480 -2.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7480 -0.1910 -1.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5760 1.3270 -2.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8380 1.8110 2.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8450 1.7220 0.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8260 0.7010 0.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6440 -0.9380 0.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7820 -4.0170 1.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -2.3990 1.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2930 -4.8470 0.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0650 -7.8830 1.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4470 -7.2110 1.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0230 -5.5280 3.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6770 -6.1500 3.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3100 -0.2650 2.9000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4760 -0.7300 3.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6080 -7.1080 5.5630 O 0 5 0 0 0 0 0 0 0 0 0 0 -5.8290 -7.4450 -0.8550 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 1 0 0 0 0 1 51 2 0 0 0 0 2 3 1 0 0 0 0 2 18 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 16 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 14 2 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 12 1 0 0 0 0 12 13 2 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 23 45 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 46 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 27 33 1 0 0 0 0 29 30 1 0 0 0 0 29 47 1 0 0 0 0 29 48 1 0 0 0 0 30 31 1 0 0 0 0 30 49 1 0 0 0 0 30 50 1 0 0 0 0 31 32 2 0 0 0 0 31 53 1 0 0 0 0 33 34 2 0 0 0 0 33 54 1 0 0 0 0 51 52 1 0 0 0 0 M CHG 1 53 -1 M CHG 1 54 -1 M END