PUBCHEM-ZINC05316468 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 0 0 0 0 0 0 0 0999 V2000 -0.5700 1.1980 -0.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3650 -0.2950 0.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.5460 1.2760 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1670 -0.7530 2.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4230 -2.2330 2.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8990 -0.5860 1.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5640 -0.2860 -0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9670 -0.3230 -0.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7880 -0.6650 0.9020 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1410 -0.9820 2.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7410 -0.9360 2.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8230 -1.3750 3.2190 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1820 -1.6230 3.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7880 -2.2940 4.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2430 -2.6150 4.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8070 -3.4550 4.8670 N 0 3 0 0 0 0 0 0 0 0 0 0 8.0230 -4.2580 5.8590 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2820 -3.7160 4.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0140 -1.9020 2.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3820 -1.2250 2.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9260 -1.1600 1.9490 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2750 -0.7000 0.8490 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9630 -0.2320 -0.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1180 -1.3330 -1.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1670 -2.3610 -1.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3670 -1.9640 -1.1060 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3720 1.7120 -0.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2450 1.3680 -0.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0130 1.6650 0.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3460 -0.7540 0.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0080 -0.7780 -0.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3860 -0.3010 3.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1340 -0.2340 2.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5090 -2.8050 2.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9500 -2.3690 3.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0390 -2.6660 2.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0100 -0.0020 -0.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3800 -0.0800 -1.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3310 -1.2050 3.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1960 -2.6190 4.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1320 -4.6620 5.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6260 -5.0980 6.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7640 -3.6040 6.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8080 -2.7620 4.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5510 -4.3460 5.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5370 -4.2260 3.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0970 -1.9520 2.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9900 -0.7500 1.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4090 0.6080 -0.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9400 0.2150 -0.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1620 -1.8310 -1.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4460 -0.8890 -2.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7020 -3.4760 -0.6840 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 6 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 34 1 0 0 0 0 5 35 1 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 9 10 2 0 0 0 0 9 22 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 21 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 19 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 18 44 1 0 0 0 0 18 45 1 0 0 0 0 18 46 1 0 0 0 0 19 20 2 0 0 0 0 19 47 1 0 0 0 0 20 21 1 0 0 0 0 20 48 1 0 0 0 0 21 22 2 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 49 1 0 0 0 0 23 50 1 0 0 0 0 24 25 1 0 0 0 0 24 51 1 0 0 0 0 24 52 1 0 0 0 0 25 26 2 0 0 0 0 25 53 1 0 0 0 0 M CHG 1 16 1 M CHG 1 53 -1 M END