IBS-ZINC02119386 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 53 0 0 0 0 0 0 0 0999 V2000 0.0430 1.4100 -0.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0830 0.0380 -0.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2730 -0.6360 -0.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3620 0.0230 -0.0850 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3830 1.3420 0.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2170 2.0910 -0.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4360 3.5100 0.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6720 3.8270 0.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7020 2.4100 0.5620 S 0 0 0 0 0 0 0 0 0 0 0 0 0.4150 4.4680 0.0190 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7170 5.8370 0.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7930 6.3760 -0.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8800 8.0970 -0.0980 S 0 0 0 0 0 0 0 0 0 0 0 0 0.3820 8.0740 0.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1320 6.7730 0.8510 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3410 6.5500 1.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9740 7.6150 2.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4070 8.8730 2.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2680 9.0580 1.4430 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0330 10.0740 2.7510 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5030 9.8060 3.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6000 8.4820 3.8350 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2700 7.3430 2.8710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3920 -2.1280 -0.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0140 -2.7850 -0.5990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8940 -2.0490 -1.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1930 -0.6600 -1.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8760 1.9540 -0.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0050 4.8320 0.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4980 4.1850 -0.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5250 5.8260 -0.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7680 5.5600 1.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5000 10.2930 3.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9600 10.9320 2.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8980 10.6150 3.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0710 9.7360 2.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8890 8.4820 4.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6120 8.3550 4.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0720 7.2490 2.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1840 6.4120 3.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8690 -2.3340 -1.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0040 -2.5420 0.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1020 -3.8320 -0.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4050 -2.7130 0.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3900 -1.9570 -2.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8250 -2.6020 -1.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8330 -0.7550 -0.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7080 -0.0700 -1.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 28 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 24 1 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 29 1 0 0 0 0 10 11 1 0 0 0 0 10 30 1 0 0 0 0 11 12 2 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 16 32 1 0 0 0 0 17 18 2 0 0 0 0 17 23 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 33 1 0 0 0 0 20 34 1 0 0 0 0 21 22 1 0 0 0 0 21 35 1 0 0 0 0 21 36 1 0 0 0 0 22 23 1 0 0 0 0 22 37 1 0 0 0 0 22 38 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 24 42 1 0 0 0 0 25 26 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 26 27 1 0 0 0 0 26 45 1 0 0 0 0 26 46 1 0 0 0 0 27 47 1 0 0 0 0 27 48 1 0 0 0 0 M END