IBS-ZINC04044710 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 61 0 0 1 0 0 0 0 0999 V2000 6.3120 -0.7540 3.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2520 -1.6910 3.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3460 -2.9260 3.9310 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4680 -3.9150 3.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6000 -5.0990 4.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7640 -6.1920 4.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7870 -6.1250 3.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6490 -4.9290 2.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4860 -3.8330 2.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9070 -7.2820 2.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4400 -7.6610 1.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5510 -8.8420 1.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2230 -9.5210 2.5170 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0220 -9.1760 0.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1900 -10.7070 -0.0260 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8210 -10.8950 -0.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1470 -11.4080 -0.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6410 -12.3820 0.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8950 -12.9730 0.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6000 -12.6260 -0.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1120 -11.7310 -1.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8820 -11.1120 -1.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2740 -10.2450 -2.3320 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9350 -9.9400 -3.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9810 -11.5810 -2.6810 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0560 -12.4620 -2.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8170 -13.1340 -1.0540 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8200 -12.8090 1.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6650 -12.7050 1.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4780 -11.0570 1.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2830 0.2120 3.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1640 -0.5910 4.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3110 -1.1880 3.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2640 -1.2400 3.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4360 -1.8500 2.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3570 -5.1710 5.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8920 -7.0960 4.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8800 -4.8210 1.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3380 -2.9310 2.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6560 -7.8480 3.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6850 -7.1340 0.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9960 -8.6790 0.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6070 -8.7290 -0.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3030 -13.7020 1.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2900 -9.2550 -4.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8810 -9.4220 -3.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0690 -10.8360 -4.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1880 -13.2140 -3.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9780 -11.8760 -2.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0450 -13.8500 2.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0840 -12.1870 2.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 -13.3190 0.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2600 -12.9920 2.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8440 -11.6280 0.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6650 -9.9900 0.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9490 -11.3990 1.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9980 -11.2750 1.1650 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.6760 -10.7230 1.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 37 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 38 1 0 0 0 0 9 39 1 0 0 0 0 10 11 2 0 0 0 0 10 40 1 0 0 0 0 11 12 1 0 0 0 0 11 41 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 42 1 0 0 0 0 14 43 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 57 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 28 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 20 21 2 0 0 0 0 20 27 1 0 0 0 0 21 22 1 0 0 0 0 21 25 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 28 29 1 0 0 0 0 28 50 1 0 0 0 0 28 51 1 0 0 0 0 29 52 1 0 0 0 0 29 53 1 0 0 0 0 29 57 1 0 0 0 0 30 54 1 0 0 0 0 30 55 1 0 0 0 0 30 56 1 0 0 0 0 30 57 1 0 0 0 0 57 58 1 0 0 0 0 M CHG 1 57 1 M END