IBS-ZINC03985227 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 54 0 0 1 0 0 0 0 0999 V2000 -0.2490 0.9130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0910 -0.4600 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1780 -1.0090 -0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2880 -0.1860 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1300 1.1870 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8610 1.7360 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6710 -0.7850 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1430 -0.9500 -1.4820 C 0 0 3 0 0 0 0 0 0 0 0 0 3.4010 -1.5170 -2.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4580 -1.6850 -1.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4970 -1.0680 -1.6010 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4790 -3.0300 -1.4040 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2960 -3.9090 -1.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7690 -5.1950 -0.6640 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2230 -5.3300 -1.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6870 -3.8630 -1.3090 C 0 0 3 0 0 0 0 0 0 0 0 0 7.2600 -3.5840 -0.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5300 -3.6880 -2.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1650 -2.9430 -3.4250 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3140 0.3710 -2.0930 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5900 0.6930 -3.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8010 -0.0970 -3.6680 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7800 2.0280 -3.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0720 2.4360 -4.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2860 3.6950 -5.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2000 4.5530 -4.8340 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9090 4.1610 -3.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7060 2.8980 -3.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3980 2.4650 -2.0580 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0400 3.0550 -1.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1820 1.2390 -1.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8050 0.9000 -0.5640 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2400 1.3420 0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9580 -1.1030 -0.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3010 -2.0820 -0.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9970 1.8300 0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7380 2.8090 0.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3560 -0.1270 0.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6490 -1.7600 0.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4840 -3.4390 -0.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9770 -4.1390 -2.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7560 -5.0640 0.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1660 -6.0540 -0.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8420 -5.8760 -0.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2370 -5.8150 -2.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3600 1.7700 -5.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7390 4.0160 -6.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3580 5.5360 -5.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6190 4.8350 -3.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6850 -4.3590 -2.6710 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1910 -4.2140 -3.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 33 1 0 0 0 0 2 3 2 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 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 7 39 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 20 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 14 42 1 0 0 0 0 14 43 1 0 0 0 0 15 16 1 0 0 0 0 15 44 1 0 0 0 0 15 45 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 2 0 0 0 0 18 50 1 0 0 0 0 20 21 1 0 0 0 0 20 31 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 26 27 2 0 0 0 0 26 48 1 0 0 0 0 27 28 1 0 0 0 0 27 49 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 31 32 2 0 0 0 0 50 51 1 0 0 0 0 M END