IFLAB-ZINC04941713 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 51 0 0 0 0 0 0 0 0999 V2000 -1.8680 0.4880 -0.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6170 0.4440 1.9120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2180 2.5060 0.7950 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9390 3.0650 2.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8140 4.5900 2.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5050 5.1250 3.2140 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5270 6.4540 3.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9740 7.2080 2.6620 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2310 6.9990 4.6350 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7840 6.2450 5.4090 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2530 8.3280 4.8570 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.9780 8.8430 5.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2640 8.1910 7.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0030 9.0520 7.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1660 10.1890 7.2400 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.5260 10.0820 6.0040 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.4630 11.0760 5.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5800 11.8520 4.7390 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5170 12.8300 3.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3390 13.0370 3.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2240 12.2650 3.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2820 11.2890 4.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2790 13.9940 2.1160 F 0 0 0 0 0 0 0 0 0 0 0 0 -6.4180 8.5010 9.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3000 7.0690 9.4950 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.9790 6.8230 7.7070 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9680 -0.5970 -0.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8210 0.7550 -0.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4660 0.8960 -1.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5510 0.6490 1.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7800 -0.6340 1.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9850 0.8720 2.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6680 2.9170 -0.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1650 2.7840 0.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9930 2.7870 1.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4890 2.6550 2.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7610 4.8680 2.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2650 5.0000 1.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9470 4.5220 3.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7630 8.9260 4.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4990 11.6900 5.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3860 13.4330 3.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3060 12.4280 2.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4100 10.6900 4.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2610 9.2450 10.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4580 8.1760 9.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6540 6.0730 7.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9400 6.5380 7.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3380 1.0420 0.7800 N 0 0 0 0 0 0 0 0 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 49 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 2 49 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 3 49 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 37 1 0 0 0 0 5 38 1 0 0 0 0 6 7 1 0 0 0 0 6 39 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 40 1 0 0 0 0 12 13 2 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 13 26 1 0 0 0 0 14 15 2 0 0 0 0 14 24 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 22 44 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 M END