PUBCHEM-ZINC03626216 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 1 0 0 0 0 0999 V2000 -4.3500 2.5510 9.9130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7700 1.4140 8.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2900 1.3460 8.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0600 0.1760 7.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8820 -0.7270 6.5600 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7700 3.8320 8.5980 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.7610 3.8320 8.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7700 3.9450 7.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1180 4.0510 7.7610 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0380 4.1550 6.7310 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6010 4.1540 5.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2480 4.0470 5.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3350 3.9490 6.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8900 3.8420 5.8640 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.5210 3.3940 4.7930 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0680 4.2010 6.6890 O 0 5 0 0 0 0 0 0 0 0 0 0 -6.6870 4.2660 4.5890 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.7540 4.7480 5.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3990 4.2690 6.7400 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9320 5.0020 9.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5240 4.8620 10.5840 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4180 6.2040 9.2050 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5010 7.3200 10.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4480 8.6430 9.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5340 9.8080 10.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3580 9.7370 11.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4110 8.4140 12.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3250 7.2490 11.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3800 1.8280 10.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0680 2.2630 9.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6030 3.5400 10.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3750 1.5040 7.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0500 0.5070 9.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0110 2.2530 7.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6860 1.2550 8.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4550 4.0520 8.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9060 4.0460 4.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7900 5.8370 5.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7090 4.3280 5.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9950 6.3310 8.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4370 7.2580 10.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5120 8.7050 8.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2860 8.6940 8.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4970 10.7510 9.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4710 9.7460 10.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4220 9.7990 10.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4200 10.5670 12.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5730 8.3630 12.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3470 8.3520 12.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3620 6.3060 11.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3880 7.3110 10.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0000 2.5820 9.3340 N 0 0 0 0 0 0 0 0 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 52 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 2 52 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 3 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 20 1 0 0 0 0 6 52 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 36 1 0 0 0 0 10 11 1 0 0 0 0 10 19 1 0 0 0 0 11 12 2 0 0 0 0 11 17 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 24 1 0 0 0 0 23 28 1 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 25 44 1 0 0 0 0 25 45 1 0 0 0 0 26 27 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 27 49 1 0 0 0 0 28 50 1 0 0 0 0 28 51 1 0 0 0 0 M CHG 1 14 1 M CHG 1 16 -1 M END