PUBCHEM-ZINC04650975 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 48 0 0 1 0 0 0 0 0999 V2000 -0.0760 1.8780 2.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4240 0.5440 1.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4770 -0.3340 1.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7460 0.1050 0.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0790 1.4650 0.9630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1680 2.3360 1.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4200 2.0070 0.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1280 1.1100 -0.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1290 -0.3300 0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6950 -0.8720 0.1290 C 0 0 3 0 0 0 0 0 0 0 0 0 2.3110 -1.0360 -0.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7270 -2.1540 0.8080 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0050 -3.3470 0.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2530 -3.4500 -1.0260 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9170 -4.5360 1.1210 C 0 0 3 0 0 0 0 0 0 0 0 0 1.8770 -4.5610 1.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2800 -5.9030 0.4920 C 0 0 3 0 0 0 0 0 0 0 0 0 3.0260 -6.0100 -0.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6710 -7.0000 1.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5140 -6.9030 2.6640 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5590 -5.8230 2.3220 C 0 0 3 0 0 0 0 0 0 0 0 0 5.4630 -5.8820 2.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7670 -6.0590 0.8230 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9300 -4.4220 2.2900 C 0 0 3 0 0 0 0 0 0 0 0 0 4.7320 -3.7170 2.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2750 -3.7730 3.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5900 -2.7390 3.2280 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7710 2.5600 2.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3910 0.1810 2.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1900 -1.3760 1.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4290 3.3810 1.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2960 3.0030 0.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0460 2.1170 1.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6260 1.1690 -1.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1560 1.4610 -0.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7110 -0.9560 -0.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6370 -0.3830 0.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5570 -2.1960 1.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6040 -6.8500 1.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7950 -7.9870 0.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9030 -6.6500 3.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0020 -7.8640 2.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1580 -7.0570 0.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3980 -5.3030 0.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5170 -4.3040 4.6260 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 4 5 2 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 24 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 23 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 24 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 26 27 2 0 0 0 0 26 45 1 0 0 0 0 M CHG 1 45 -1 M END