PUBCHEM-ZINC05888740 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 57 0 0 1 0 0 0 0 0999 V2000 0.2250 1.3010 -0.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0960 -0.1130 -0.1610 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1570 -0.6350 0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3400 0.1080 0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5820 -0.5250 0.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6310 -1.9200 0.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4580 -2.6800 0.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2270 -2.0270 0.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0720 -2.7750 0.1400 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5050 -2.9130 1.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4050 -4.0420 0.5330 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6020 -4.7160 0.8970 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8550 0.2780 0.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6420 1.2020 -1.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9860 1.5200 -2.7880 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.1400 2.0610 -3.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2150 2.4410 -2.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4970 2.8810 -4.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5530 1.7290 -5.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9420 0.5160 -4.9490 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0660 -0.4530 -5.9370 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7070 -0.2300 -7.0980 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.2480 0.9770 -7.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1940 1.9730 -6.3980 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.9010 1.2120 -8.4700 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.5450 -1.7190 -5.7920 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.2580 0.2560 -3.6310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2900 1.5360 -0.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2790 1.7040 -1.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1450 1.7710 0.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3180 1.1850 -0.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5990 -2.3990 0.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4160 -3.5100 1.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7820 -1.9400 1.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1710 -3.4410 2.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0110 -4.3240 1.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3410 -4.6640 0.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3570 -5.7710 1.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6520 -0.2190 0.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7010 1.2760 0.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5170 2.1280 -0.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4110 0.5840 -0.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0890 1.9180 -2.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0540 3.3300 -2.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4440 3.4330 -4.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7090 3.5670 -4.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9480 0.4690 -9.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3090 2.1190 -8.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0410 -2.0360 -4.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6990 -2.3440 -6.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3000 -0.2450 -3.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8910 -0.4350 -3.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3480 0.4570 -1.2210 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.6180 0.9450 -1.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4320 -0.4750 -1.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 13 1 0 0 0 0 6 7 2 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 13 53 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 14 53 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 27 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 18 46 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 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 26 1 0 0 0 0 22 23 2 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 53 54 1 0 0 0 0 53 55 1 0 0 0 0 M CHG 1 53 1 M END