PUBCHEM-ZINC04556679 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 43 0 0 1 0 0 0 0 0999 V2000 -0.0020 0.1250 -2.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0050 0.3900 -1.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9070 1.5690 -1.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8720 -0.8460 -0.7150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0880 -2.0790 -0.2510 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4130 -2.4290 -1.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0690 -3.2830 0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8090 -3.9090 1.1340 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2950 -1.7930 0.9540 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8090 -2.5740 1.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5980 -3.0290 0.4350 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7590 -3.0620 2.7110 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3400 -2.2790 3.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1390 -3.5110 3.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2100 -3.8140 4.7080 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6490 -4.1600 5.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7840 -4.4120 6.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5450 1.0390 -2.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7400 -0.6220 -1.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5040 -0.2320 -3.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4460 0.6800 -0.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6080 1.7990 -0.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3120 2.4680 -1.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4900 1.3500 -2.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5980 -0.5750 0.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4630 -1.1020 -1.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6470 -1.0980 1.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4720 -4.3930 2.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8620 -2.7170 2.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8650 -2.9410 5.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5460 -4.6500 4.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9800 -5.0470 4.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3160 -3.3380 4.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5290 -3.5260 7.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1790 -5.2620 6.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9680 -3.5030 -0.8110 O 0 5 0 0 0 0 0 0 0 0 0 0 5.1990 -4.7430 6.9300 N 0 3 0 0 0 0 0 0 0 0 0 0 5.3390 -4.9280 7.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8300 -3.9740 6.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5010 -5.5810 6.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2040 -4.2140 2.7580 N 0 3 0 0 0 0 0 0 0 0 0 0 0.1820 -5.0820 2.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0300 -4.0370 2.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6620 -4.3830 3.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 21 1 0 0 0 0 3 22 1 0 0 0 0 3 23 1 0 0 0 0 3 24 1 0 0 0 0 4 5 1 0 0 0 0 4 25 1 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 7 8 2 0 0 0 0 7 36 1 0 0 0 0 9 10 1 0 0 0 0 9 27 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 41 1 0 0 0 0 14 15 1 0 0 0 0 14 28 1 0 0 0 0 14 29 1 0 0 0 0 15 16 1 0 0 0 0 15 30 1 0 0 0 0 15 31 1 0 0 0 0 16 17 1 0 0 0 0 16 32 1 0 0 0 0 16 33 1 0 0 0 0 17 34 1 0 0 0 0 17 35 1 0 0 0 0 17 37 1 0 0 0 0 37 38 1 0 0 0 0 37 39 1 0 0 0 0 37 40 1 0 0 0 0 41 42 1 0 0 0 0 41 43 1 0 0 0 0 41 44 1 0 0 0 0 M CHG 1 36 -1 M CHG 1 37 1 M CHG 1 41 1 M END