IBS-ZINC04089666 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 52 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.4480 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5980 -0.6000 -1.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0880 0.0700 -1.9210 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6580 -2.1040 -1.1200 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.3550 -2.5070 -1.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4120 -2.6470 0.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3650 -4.1530 0.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3550 -4.8700 -0.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3130 -6.2520 -0.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2800 -6.9170 0.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2900 -6.2000 0.7070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3350 -4.8180 0.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3540 -2.5030 -2.3450 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6750 -2.5990 -3.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5160 -2.3550 -3.5350 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3150 -2.9660 -4.6330 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5770 -3.0710 -5.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5320 -3.5020 -7.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7720 -3.6100 -8.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2310 -4.7240 -8.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3800 -4.4350 -10.0150 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8410 -5.0790 -10.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2440 -3.0950 -10.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4780 -2.5180 -9.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7640 -1.1510 -9.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3380 -0.3800 -10.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3780 -0.9440 -11.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6650 -2.2910 -11.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8250 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8090 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7990 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4490 -2.3150 0.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9450 -2.2770 1.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1620 -4.3510 -1.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0860 -6.8120 -1.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2460 -7.9960 0.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5170 -6.7190 1.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4360 -4.2580 1.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3040 -2.6980 -2.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2650 -3.1610 -4.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2170 -3.8100 -5.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1420 -2.1030 -6.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3260 -2.7630 -7.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9660 -4.4700 -6.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2730 -5.7020 -8.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3210 -0.7060 -8.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5590 0.6770 -10.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7090 -0.3210 -12.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2250 -2.7200 -12.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 14 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 11 12 2 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 14 40 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 41 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 20 21 2 0 0 0 0 20 25 1 0 0 0 0 21 22 1 0 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 27 28 2 0 0 0 0 27 48 1 0 0 0 0 28 29 1 0 0 0 0 28 49 1 0 0 0 0 29 50 1 0 0 0 0 M END