NCID-ZINC04760613 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 54 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7180 -0.4980 -1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7390 -2.0270 -1.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4550 -2.5210 -2.5240 C 0 0 3 0 0 0 0 0 0 0 0 0 2.4470 -2.0720 -2.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5840 -4.0210 -2.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0800 -4.7030 -3.3400 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2600 -4.6060 -1.4640 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3850 -6.0640 -1.4140 C 0 0 3 0 0 0 0 0 0 0 0 0 2.4680 -6.4570 -2.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1500 -6.6600 -0.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9630 -6.0160 0.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0850 -6.3890 -1.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6170 -6.4360 -0.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3180 -5.5710 -0.1600 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6820 -2.1370 -3.7080 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8440 -0.9140 -4.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6310 -0.1300 -3.7600 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1330 -0.5620 -5.3390 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3590 0.7700 -5.8710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5170 0.9840 -7.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7860 1.5110 -6.9270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5890 1.7080 -8.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1240 1.3780 -9.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8540 0.8520 -9.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0490 0.6600 -8.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1910 -0.1360 -2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7410 -0.1200 -1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2660 -2.3880 -0.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2840 -2.4050 -1.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6630 -4.0600 -0.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2820 -7.7350 -0.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8300 -4.9410 0.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0820 -6.4410 1.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8420 -6.2090 1.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0480 -6.8470 -2.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9650 -6.8130 -1.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2180 -5.3130 -1.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0540 -2.7630 -4.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1160 1.5110 -5.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4060 0.8740 -6.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1500 1.7690 -5.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5810 2.1190 -7.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7520 1.5310 -10.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4910 0.5940 -10.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9440 0.2520 -8.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9350 -7.7280 -0.4520 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7340 -7.9170 0.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 17 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 15 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 38 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 42 1 0 0 0 0 14 43 1 0 0 0 0 14 44 1 0 0 0 0 15 16 2 0 0 0 0 15 53 1 0 0 0 0 17 18 1 0 0 0 0 17 45 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 46 1 0 0 0 0 21 47 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 25 26 2 0 0 0 0 25 50 1 0 0 0 0 26 27 1 0 0 0 0 26 51 1 0 0 0 0 27 52 1 0 0 0 0 53 54 1 0 0 0 0 M END