PUBCHEM-ZINC06591502 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 49 0 0 1 0 0 0 0 0999 V2000 0.3080 1.6310 -0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1820 0.1200 -0.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0280 -0.5840 1.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0620 -2.1000 0.9690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1440 -2.6630 0.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3120 -1.9510 -1.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3900 -0.4350 -0.9840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0070 -4.1690 -0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0460 -4.7740 0.1700 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1830 -4.7630 -0.4070 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3290 -6.1850 -0.7550 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5810 -6.7630 -0.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2230 -6.4400 -2.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9240 -6.0020 -2.8770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3070 -6.6020 -2.6950 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2430 -5.8800 -3.3820 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2320 -6.0830 -3.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6460 -4.8330 -4.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7170 -4.8860 -3.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5640 -3.9080 -4.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0200 -2.9160 -5.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3460 -2.8870 -5.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2060 -3.8470 -4.8650 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7580 -6.6950 -0.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6360 -5.7790 -0.3770 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1950 1.8880 0.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3860 2.1350 -1.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5700 2.0330 0.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7210 -0.0720 -0.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8790 -0.3400 1.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8730 -0.2220 1.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1300 -2.5710 1.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9930 -2.3480 0.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0450 -2.4950 0.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2180 -2.3030 -1.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4700 -2.2040 -1.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4500 0.0280 -1.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3180 -0.1760 -0.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0570 -4.2420 -0.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0480 -5.9390 -2.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3470 -7.5120 -2.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5950 -7.4610 -2.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6290 -3.9160 -4.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6720 -2.1600 -5.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7520 -2.1070 -6.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2700 -3.8230 -5.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8730 -7.9420 -0.2740 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 7 1 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 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 6 36 1 0 0 0 0 7 37 1 0 0 0 0 7 38 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 24 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 15 2 0 0 0 0 14 19 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 21 22 2 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 23 46 1 0 0 0 0 24 25 2 0 0 0 0 24 47 1 0 0 0 0 M CHG 1 47 -1 M END