IBS-ZINC05026852 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 1 0 0 0 0 0999 V2000 0.1680 1.0510 1.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1690 -0.4650 1.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8510 -0.7760 0.1990 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9420 -2.0870 -0.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5930 -2.4580 -1.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6870 -3.7820 -1.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1270 -4.7610 -0.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4720 -4.3820 0.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3880 -3.0560 0.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2250 -6.1800 -1.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7920 -6.5060 -2.2110 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6210 -7.2320 -0.2950 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6340 -7.7010 0.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8350 -9.1570 0.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5850 -9.8640 1.1250 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0780 -9.5840 -0.5350 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2830 -8.4950 -1.1020 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5450 -8.3490 -2.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1860 -8.8100 -0.9770 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0990 -8.6080 -1.9270 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3890 -8.9750 -1.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5230 -9.4750 -0.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9550 -9.5060 0.4430 S 0 0 0 0 0 0 0 0 0 0 0 0 1.0510 -10.9660 -1.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0160 -11.1110 -2.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3560 -10.9050 -1.7460 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3490 -11.1290 -2.7480 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7410 -11.0010 -2.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9340 -12.0480 -1.1720 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1720 -7.0290 1.5750 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1960 1.4100 1.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3400 1.5330 0.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3520 1.2880 2.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6770 -0.9470 2.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8580 -0.8240 1.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0240 -1.7020 -1.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1930 -4.0690 -2.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -5.1330 0.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1120 -2.7630 1.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8520 -8.1890 -2.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2240 -8.8640 -2.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4510 -9.8120 0.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3540 -11.6390 -0.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -11.2170 -1.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9250 -12.1120 -2.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7730 -10.3710 -2.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2280 -12.1290 -3.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2370 -10.3900 -3.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4970 -11.0760 -2.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8280 -10.0360 -1.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7970 -12.0290 -0.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2710 -6.8440 0.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 9 39 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 17 1 0 0 0 0 12 52 1 0 0 0 0 13 14 1 0 0 0 0 13 30 2 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 24 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 20 2 0 0 0 0 19 23 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 21 22 2 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 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 25 46 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 27 47 1 0 0 0 0 27 48 1 0 0 0 0 28 29 1 0 0 0 0 28 49 1 0 0 0 0 28 50 1 0 0 0 0 29 51 1 0 0 0 0 M END