NCID-ZINC05461720 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 55 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 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.5340 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6820 -0.4720 -1.1930 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9630 -0.0920 -1.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4990 0.6120 -0.5220 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6520 -0.4920 -2.4430 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0460 -0.0790 -2.6200 C 0 0 3 0 0 0 0 0 0 0 0 0 4.5370 -0.0310 -1.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0880 1.3000 -3.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4750 2.3370 -2.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5260 3.9720 -3.1230 S 0 0 0 0 0 0 0 0 0 0 0 0 2.7690 5.0480 -1.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7590 -1.0780 -3.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1610 -2.0400 -3.9270 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0600 -0.9010 -3.7960 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7530 -1.8730 -4.6460 C 0 0 3 0 0 0 0 0 0 0 0 0 6.0640 -2.2530 -5.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9380 -1.1930 -5.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4290 -0.1310 -6.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2470 1.1630 -5.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7810 2.1370 -6.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4970 1.8180 -8.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6800 0.5240 -8.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1500 -0.4490 -7.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2530 -3.0150 -3.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0510 -3.0170 -2.6090 O 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 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -1.6010 1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9600 -0.1730 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4180 -1.6240 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9440 -0.1820 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2240 -1.0540 -3.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1230 1.5690 -3.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5210 1.2750 -4.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4410 2.0680 -2.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0430 2.3630 -1.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7460 6.0730 -2.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7520 4.7110 -1.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3540 5.0060 -0.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5380 -0.1320 -3.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5820 -0.7350 -4.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5060 -1.9340 -5.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4690 1.4130 -4.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6380 3.1480 -6.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1320 2.5780 -8.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4570 0.2740 -9.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2960 -1.4590 -7.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9230 -4.0290 -4.3690 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2240 -4.7390 -3.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 5 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 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 38 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 15 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 12 13 1 0 0 0 0 12 41 1 0 0 0 0 12 42 1 0 0 0 0 13 14 1 0 0 0 0 14 43 1 0 0 0 0 14 44 1 0 0 0 0 14 45 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 46 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 27 1 0 0 0 0 20 21 1 0 0 0 0 20 47 1 0 0 0 0 20 48 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 49 1 0 0 0 0 23 24 1 0 0 0 0 23 50 1 0 0 0 0 24 25 2 0 0 0 0 24 51 1 0 0 0 0 25 26 1 0 0 0 0 25 52 1 0 0 0 0 26 53 1 0 0 0 0 27 28 2 0 0 0 0 27 54 1 0 0 0 0 54 55 1 0 0 0 0 M END