IBS-ZINC01747593 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 56 0 0 0 0 0 0 0 0999 V2000 -0.0160 1.3060 0.0090 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 1.3170 -0.7400 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3700 -1.7170 1.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7050 -2.4640 1.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7570 -3.4410 2.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0930 -4.1880 2.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1450 -5.1660 3.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4800 -5.9120 3.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5330 -6.8900 4.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8480 -7.6260 4.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6630 -7.3910 3.7560 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1180 -8.5440 5.5710 N 0 0 0 0 0 0 0 0 0 0 0 0 8.3280 -9.2210 5.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7000 -10.1680 6.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0200 -10.7200 6.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6020 -10.1830 5.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5510 -8.9910 4.3940 S 0 0 0 0 0 0 0 0 0 0 0 0 11.9810 -10.5620 4.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7270 -11.3000 5.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8300 -12.4130 6.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6730 -11.7870 7.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8500 -10.5850 7.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0700 -11.5090 7.4490 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9330 -9.9460 8.7720 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9120 1.8580 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9580 1.8330 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4130 -1.2910 -0.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1350 -0.0240 0.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2740 -1.1660 2.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5520 -2.4330 1.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8010 -3.0150 0.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5230 -1.7480 1.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6610 -2.8900 3.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9400 -4.1570 2.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1890 -4.7400 1.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9100 -3.4730 2.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0490 -4.6140 4.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3270 -5.8810 3.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5760 -6.4640 2.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2980 -5.1970 3.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4360 -6.3380 5.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7150 -7.6060 4.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4660 -8.7310 6.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8860 -11.2130 3.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5300 -9.6620 4.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6430 -11.7340 5.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9720 -10.6010 6.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4330 -13.0030 5.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4110 -13.0560 6.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0550 -11.3330 7.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9410 -12.5550 7.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5550 -9.2100 8.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3710 -10.2220 9.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 8 39 1 0 0 0 0 8 40 1 0 0 0 0 9 10 1 0 0 0 0 9 41 1 0 0 0 0 9 42 1 0 0 0 0 10 11 1 0 0 0 0 10 43 1 0 0 0 0 10 44 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 45 1 0 0 0 0 14 15 2 0 0 0 0 14 18 1 0 0 0 0 15 16 1 0 0 0 0 15 23 1 0 0 0 0 16 17 2 0 0 0 0 16 22 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 46 1 0 0 0 0 19 47 1 0 0 0 0 20 21 1 0 0 0 0 20 48 1 0 0 0 0 20 49 1 0 0 0 0 21 22 1 0 0 0 0 21 50 1 0 0 0 0 21 51 1 0 0 0 0 22 52 1 0 0 0 0 22 53 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 54 1 0 0 0 0 25 55 1 0 0 0 0 M END