PUBCHEM-ZINC05644311 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 52 0 0 1 0 0 0 0 0999 V2000 0.0690 1.5050 0.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0470 -0.0190 0.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0200 -0.0490 -0.9970 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6660 1.1800 -1.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2830 1.6270 -2.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2670 0.8630 -3.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6390 -0.3680 -3.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0270 -0.8300 -2.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3880 -2.1580 -2.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0500 -3.0370 -3.0600 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1940 -2.9250 -4.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4650 -4.1150 -2.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0870 -5.2900 -2.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6000 -6.1820 -2.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5690 -5.9250 -0.6520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0290 -4.7740 -0.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4980 -3.8490 -1.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0830 -2.6590 -0.8850 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.4070 -1.9370 0.3500 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6950 -2.2150 1.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7980 -2.3120 0.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6520 -2.9560 -0.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9280 -3.3000 0.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3520 -3.0000 1.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5020 -2.3560 2.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2190 -2.0150 2.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8420 -3.9900 -0.6100 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.4700 -4.2550 -1.7390 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.9660 -4.2940 -0.2530 O 0 5 0 0 0 0 0 0 0 0 0 0 1.1010 1.8550 0.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4670 1.9520 -0.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4120 1.7940 1.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5280 -0.3070 -0.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5830 -0.4660 0.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6870 1.7850 -0.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7840 2.5840 -2.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7460 1.2300 -4.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6260 -0.9660 -4.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1140 -5.4980 -3.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0370 -7.1070 -2.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9830 -6.6560 0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0110 -4.5870 0.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3240 -3.1910 -1.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3500 -3.2690 1.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8330 -2.1210 3.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3780 -1.3860 2.9450 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3440 -0.4910 0.1310 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4340 -0.4220 2.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 2 47 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 3 47 1 0 0 0 0 4 5 2 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 6 7 2 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 18 2 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 17 2 0 0 0 0 13 14 2 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 15 16 2 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 47 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 23 27 1 0 0 0 0 24 25 2 0 0 0 0 24 44 1 0 0 0 0 25 26 1 0 0 0 0 25 45 1 0 0 0 0 26 46 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 46 48 1 0 0 0 0 M CHG 1 18 1 M CHG 1 27 1 M CHG 1 29 -1 M END