IBS-ZINC06163809 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 49 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 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 1.2260 -0.6930 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2480 -2.0420 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0850 -2.7570 -0.0140 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1710 -4.0990 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5250 -4.2480 -0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0840 -3.0280 0.0040 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1260 -2.1130 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1640 -0.7030 0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2580 -5.5390 -0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5580 -6.7410 0.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2440 -7.9380 0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6240 -7.9470 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3240 -6.7580 -0.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6480 -5.5540 -0.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0820 -6.7780 -0.2210 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.4580 -5.5540 -0.8370 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4340 -8.0520 -0.7430 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.6770 -6.7260 1.3240 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.9570 -5.4390 1.9750 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4030 -5.4470 2.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6170 -6.6660 3.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3800 -7.9460 2.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9390 -7.9660 2.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1540 -0.1400 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1950 -2.5620 -0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5620 -4.8930 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1110 -0.1840 0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4800 -6.7350 0.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7020 -8.8700 0.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1570 -8.8860 -0.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1960 -4.6250 -0.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2770 -5.2980 2.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8260 -4.6300 1.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5940 -4.5370 3.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0850 -5.4970 1.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9170 -6.6290 4.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6380 -6.6620 3.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5550 -8.8140 3.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0630 -7.9720 1.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7970 -8.8230 1.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2570 -8.0350 2.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 10 2 0 0 0 0 3 4 2 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 6 7 2 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 33 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 14 15 2 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 16 36 1 0 0 0 0 17 18 2 0 0 0 0 17 19 2 0 0 0 0 17 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 1 0 0 0 0 21 22 1 0 0 0 0 21 37 1 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 22 40 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 M END