PUBCHEM-ZINC06816898 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.4610 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.6900 1.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0800 1.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7570 -0.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0540 -3.9730 -0.1880 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0030 -1.2420 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6620 -1.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0290 -0.0200 -2.2030 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.6580 -2.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -2.5010 2.4640 N 0 3 0 0 0 0 0 0 0 0 0 0 0.0530 -1.4640 3.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0300 -0.3230 2.5030 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0210 0.5850 2.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0820 -3.8990 2.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5040 -4.3970 2.9180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4100 -3.6570 2.5980 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7700 -5.6650 3.2900 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1520 -6.1490 3.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1770 -7.6790 3.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8420 -8.2490 4.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6200 -7.1510 5.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8020 -5.8430 4.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8380 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8220 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.8120 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0120 -2.8340 -2.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5140 -2.0170 -3.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5440 -3.6090 -2.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0630 -1.5020 4.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3420 -3.9740 3.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5060 -4.5040 2.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0450 -6.2570 3.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7230 -5.6770 2.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1610 -8.0610 3.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7610 -7.9490 2.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3570 -9.1780 4.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9070 -8.4100 4.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6130 -7.2120 5.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3680 -7.2240 6.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8610 -5.6160 4.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2880 -5.0160 5.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 8 1 0 0 0 0 3 4 2 0 0 0 0 3 13 1 0 0 0 0 4 5 1 0 0 0 0 4 11 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 10 1 0 0 0 0 8 9 2 0 0 0 0 10 27 1 0 0 0 0 10 28 1 0 0 0 0 10 29 1 0 0 0 0 11 12 2 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 30 1 0 0 0 0 13 14 1 0 0 0 0 15 16 1 0 0 0 0 15 31 1 0 0 0 0 15 32 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 33 1 0 0 0 0 19 20 1 0 0 0 0 19 23 1 0 0 0 0 19 34 1 0 0 0 0 20 21 1 0 0 0 0 20 35 1 0 0 0 0 20 36 1 0 0 0 0 21 22 1 0 0 0 0 21 37 1 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 22 40 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 M CHG 1 11 1 M END