PUBCHEM-ZINC06911845 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 1 0 0 0 0 0999 V2000 -1.0810 2.4930 -1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5070 1.2220 -0.5710 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0580 1.4580 0.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4180 0.5100 -1.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1180 -0.5790 -2.0650 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5690 1.1970 -1.8730 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5840 0.7250 -2.8260 C 0 0 3 0 0 0 0 0 0 0 0 0 2.0550 0.2130 -3.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5470 -0.2330 -2.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4860 -1.6060 -2.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3640 -2.5020 -1.8190 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3110 -2.0400 -0.9070 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3730 -0.6820 -0.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4930 0.2150 -1.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3730 1.9100 -3.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3460 2.9800 -2.7680 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5670 0.2780 -0.2240 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4180 0.4440 0.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3090 1.3950 1.6190 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4430 -0.5870 0.9930 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7550 -1.6470 0.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8440 -2.3720 0.7030 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5640 -3.5110 0.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6200 -4.0000 1.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9550 -3.3560 2.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2520 -2.2220 2.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1950 -1.7440 1.8950 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3360 -0.6720 2.0550 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.3620 0.2430 3.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2380 -5.1090 0.5520 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.3050 -5.6630 1.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2900 3.2070 -1.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6300 2.2700 -2.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7750 2.9920 -0.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7910 2.1050 -1.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7480 -1.9830 -3.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3040 -3.5610 -2.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9970 -2.7370 -0.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1070 -0.3180 0.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5540 1.2720 -0.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6340 -0.5350 -0.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2630 -1.8870 -0.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3020 -4.0100 -0.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7680 -3.7080 2.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5350 -1.7380 3.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6190 1.2390 2.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1080 -0.0680 3.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3780 0.2360 3.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9560 -6.0030 2.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1310 -4.9520 1.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6810 -6.5370 0.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9170 1.6840 -4.5750 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 17 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 15 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 12 13 2 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 14 40 1 0 0 0 0 15 16 2 0 0 0 0 15 52 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 2 0 0 0 0 20 28 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 24 30 1 0 0 0 0 25 26 2 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 27 28 1 0 0 0 0 28 29 1 0 0 0 0 29 46 1 0 0 0 0 29 47 1 0 0 0 0 29 48 1 0 0 0 0 30 31 1 0 0 0 0 31 49 1 0 0 0 0 31 50 1 0 0 0 0 31 51 1 0 0 0 0 M CHG 1 52 -1 M END