IBS-ZINC02098387 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 58 0 0 1 0 0 0 0 0999 V2000 0.5530 1.3110 -0.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2720 -0.1930 -0.0210 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7040 -0.6640 -0.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0680 -0.7400 1.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9860 -2.2580 1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3900 -2.7830 1.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4040 -2.0650 0.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2650 -0.5970 0.0480 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.8950 -0.4190 -1.3890 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1110 -0.6930 -2.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1030 -1.2850 -1.7840 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.9770 -1.4530 -2.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1540 -2.6700 -1.1730 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.5220 -3.3590 -1.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7540 -2.7070 0.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5150 -3.0940 -1.3190 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3200 -2.0230 -1.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5460 -2.0410 -1.5080 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5350 -0.7530 -1.6910 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.8040 -0.3010 -2.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9520 0.1700 -0.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9900 1.3380 0.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4350 1.6810 0.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0870 2.4630 1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4300 2.7550 0.8270 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.1150 3.4970 1.8300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2480 0.9340 -1.6670 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5630 1.3070 -2.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9750 0.2790 1.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6290 1.4860 -0.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0720 1.7490 -1.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2290 1.8630 0.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1240 -0.4510 1.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7020 -0.3010 2.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6670 -2.7060 0.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3230 -2.5840 2.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 -3.8270 1.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7620 -3.7520 0.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5040 -2.2120 0.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9170 -0.3350 0.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3860 1.1020 -0.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3820 2.2390 0.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9170 0.7030 1.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4920 2.2670 -0.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0130 0.7670 -0.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0860 1.8690 2.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5440 3.3990 1.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.1340 3.6870 1.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1640 2.9260 2.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6190 4.4580 2.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0320 1.3300 0.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9950 -0.0520 1.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4590 0.2450 2.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4000 0.5720 -0.7480 N 0 3 0 0 0 0 0 0 0 0 0 0 -6.4910 1.1220 -1.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9590 -0.2940 -0.9130 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 2 4 1 0 0 0 0 2 8 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 5 36 1 0 0 0 0 6 7 2 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 7 15 1 0 0 0 0 8 9 1 0 0 0 0 8 29 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 27 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 19 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 16 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 21 54 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 22 54 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 24 25 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 48 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 27 28 1 0 0 0 0 29 51 1 0 0 0 0 29 52 1 0 0 0 0 29 53 1 0 0 0 0 54 55 1 0 0 0 0 54 56 1 0 0 0 0 M CHG 1 54 1 M END