CHEMSTAR-ZINC04554354 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 56 0 0 1 0 0 0 0 0999 V2000 0.1950 1.4300 -0.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0340 -0.0840 -0.0050 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4120 -0.5410 -0.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8490 -0.6160 1.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7360 -2.1310 1.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7150 -2.6080 1.3760 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0860 -2.4980 2.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6720 -1.9450 0.3990 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.7070 -2.0850 0.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4440 -0.4560 0.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5380 -2.8180 -0.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7650 -2.4200 -1.9610 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1500 -4.0780 -0.3980 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7940 -4.0510 0.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5530 -4.9730 1.7090 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1210 -5.2440 -1.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7820 -5.2720 -2.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7560 -6.4090 -3.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0620 -7.5480 -2.8710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3710 -7.5770 -1.6520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4270 -6.4090 -0.8490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3830 -8.7720 -1.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8720 -9.7540 -2.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5690 -10.8650 -1.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7870 -10.9400 -0.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5090 -11.9660 0.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6870 -11.9640 1.9030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1510 -10.9350 2.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4460 -9.9140 2.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2580 -9.8930 0.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5790 -8.8560 0.1390 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0470 -11.9100 -2.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0390 -13.1270 -2.1610 O 0 5 0 0 0 0 0 0 0 0 0 0 1.2470 1.6970 -0.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3710 1.8100 -0.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1600 1.9480 0.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9040 -0.3410 1.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5030 -0.1600 2.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2330 -2.5800 0.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2960 -2.4860 2.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8540 0.0930 1.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0090 -0.1210 -0.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3580 -4.4250 -2.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2880 -6.4100 -4.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0860 -8.4160 -3.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1240 -6.4290 0.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7370 -9.6800 -3.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9460 -12.7860 -0.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2420 -12.7670 2.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2800 -10.9190 3.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0320 -9.1030 2.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3980 -11.4860 -3.6730 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 10 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 39 1 0 0 0 0 5 40 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 14 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 11 1 0 0 0 0 10 41 1 0 0 0 0 10 42 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 14 15 2 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 19 20 2 0 0 0 0 19 45 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 22 31 2 0 0 0 0 23 24 2 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 24 32 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 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 2 0 0 0 0 28 50 1 0 0 0 0 29 30 1 0 0 0 0 29 51 1 0 0 0 0 30 31 1 0 0 0 0 32 33 1 0 0 0 0 32 52 2 0 0 0 0 M CHG 1 33 -1 M END