IBS-ZINC04025051 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 45 0 0 1 0 0 0 0 0999 V2000 1.1090 1.6220 2.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1930 0.1030 2.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5210 -0.5420 1.2520 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3040 0.1800 0.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7640 0.1840 0.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6280 -1.9310 1.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3210 -2.7990 1.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3160 -4.1570 1.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7340 -4.7640 0.6590 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1030 -3.8760 -0.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 -2.5380 0.0350 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0260 -4.7470 2.7150 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4460 -3.7520 3.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0370 -2.5680 3.1570 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2800 -6.1720 2.8730 C 0 0 3 0 0 0 0 0 0 0 0 0 2.1700 -6.6310 1.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3830 -6.8300 3.9650 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7120 -6.0680 4.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4150 -7.1830 5.0550 C 0 0 3 0 0 0 0 0 0 0 0 0 2.4790 -6.3700 5.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7160 -7.3320 4.2860 C 0 0 3 0 0 0 0 0 0 0 0 0 3.7960 -8.3090 3.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6720 -6.3260 3.2570 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9490 -7.1030 5.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1230 -7.1990 4.3400 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9080 -6.7050 3.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0480 -8.3860 5.7220 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3950 -8.7320 5.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8540 -7.9680 3.5190 O 0 5 0 0 0 0 0 0 0 0 0 0 0.0720 1.9700 2.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6230 2.0060 3.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5910 2.0650 1.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2590 -0.1540 2.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7600 -0.2700 3.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0340 1.2150 0.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2150 -0.2420 -0.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3680 0.7560 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1700 -0.8310 0.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8830 0.6380 1.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4030 -4.2840 -0.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0400 -3.9500 4.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9440 -6.1010 5.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0210 -7.8430 5.9520 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 3 1 0 0 0 0 2 33 1 0 0 0 0 2 34 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 35 1 0 0 0 0 4 36 1 0 0 0 0 5 37 1 0 0 0 0 5 38 1 0 0 0 0 5 39 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 14 1 0 0 0 0 8 9 1 0 0 0 0 8 12 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 10 40 1 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 13 14 2 0 0 0 0 13 41 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 23 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 29 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 27 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 24 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 27 28 1 0 0 0 0 M CHG 1 29 -1 M END