NCID-ZINC04771572 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 43 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0230 -0.6920 1.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -2.0970 1.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -2.7440 2.1820 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -2.7180 -0.0520 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -1.9800 -1.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0050 -0.6620 -1.1550 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0520 -3.6870 -0.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 -2.6160 -2.4070 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 0.0430 2.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4080 0.1630 3.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4050 0.9100 4.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7780 1.0240 4.8510 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0200 1.6490 6.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1000 2.1160 6.6620 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4080 1.7650 6.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6590 2.4110 7.7350 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9500 2.5190 8.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0070 1.9820 7.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7560 1.3360 6.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4650 1.2330 5.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3930 2.0980 7.9710 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6120 2.6600 9.0250 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0280 -3.5850 -2.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -2.0980 -3.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6290 -0.5060 3.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4450 1.0390 2.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0120 0.7130 2.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8280 -0.8330 3.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8010 0.3600 5.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9850 1.9060 4.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5130 0.6510 4.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8410 2.8260 8.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1440 3.0190 9.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5740 0.9200 5.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2710 0.7370 4.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4130 1.5790 7.2600 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.3010 1.6790 7.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 8 1 0 0 0 0 3 4 1 0 0 0 0 3 11 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 9 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 10 28 1 0 0 0 0 10 29 1 0 0 0 0 11 12 1 0 0 0 0 11 30 1 0 0 0 0 11 31 1 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 12 33 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 22 40 1 0 0 0 0 23 24 2 0 0 0 0 23 41 1 0 0 0 0 41 42 1 0 0 0 0 M END