PUBCHEM-ZINC06349962 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 44 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7180 -0.4980 -1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7390 -2.0270 -1.2650 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1870 -2.3900 -0.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5500 -2.5120 -2.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0350 -3.2090 -3.2820 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7440 -3.8870 -0.8120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1640 -4.3740 -0.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5760 -5.0670 -2.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8860 -5.4980 -2.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7430 -5.2570 -1.1810 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.3920 -4.6000 -0.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0920 -4.1420 0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7330 -3.4710 1.1940 O 0 5 0 0 0 0 0 0 0 0 0 0 -5.4100 -4.3510 0.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6060 -5.3480 -3.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2720 -6.0720 -4.2240 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5360 -6.5420 -5.5770 P 0 0 0 0 0 0 0 0 0 0 0 0 -0.3370 -7.3390 -5.2360 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1910 -0.1360 -2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7410 -0.1200 -1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4630 -3.8650 0.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0780 -4.5600 -1.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2130 -6.0390 -3.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6560 -5.5720 -1.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3940 -5.1760 1.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1710 -3.4210 1.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4020 -4.2740 0.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2280 -4.4070 -3.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7740 -5.9420 -2.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8430 -2.1700 -2.5500 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6350 -2.5350 -1.3760 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2900 -1.9060 -0.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5460 -7.4390 -6.4530 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0960 -5.2460 -6.4260 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8330 -4.6760 -6.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1690 -7.7570 -7.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3220 -2.5050 -3.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 24 1 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 38 1 0 0 0 0 6 7 2 0 0 0 0 6 37 1 0 0 0 0 8 9 1 0 0 0 0 8 28 1 0 0 0 0 8 29 1 0 0 0 0 8 38 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 17 1 0 0 0 0 11 12 1 0 0 0 0 11 30 1 0 0 0 0 12 13 2 0 0 0 0 12 31 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 16 32 1 0 0 0 0 16 33 1 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 19 40 1 0 0 0 0 19 41 1 0 0 0 0 37 44 1 0 0 0 0 38 39 1 0 0 0 0 40 43 1 0 0 0 0 41 42 1 0 0 0 0 M CHG 1 12 1 M CHG 1 15 -1 M END