IFLAB-ZINC04519557 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 53 0 0 1 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 -0.7020 1.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0840 1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7680 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0710 -1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6890 -1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0640 -4.5300 -0.0230 S 0 0 0 0 0 0 0 0 0 0 0 0 0.6620 -4.8650 -1.2680 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6870 -4.8790 1.2060 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6860 -5.0080 -0.0070 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1620 -4.6130 0.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7980 -6.5340 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1320 -7.0780 1.1720 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1050 -8.4100 1.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6320 -9.1590 0.5790 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4330 -8.9590 2.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1730 -8.1000 3.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7970 -8.6190 4.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8240 -9.9870 4.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2250 -10.8430 3.9110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4080 -10.3370 2.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2590 -12.3310 4.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5080 -10.5460 6.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3700 -4.4480 -1.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4000 -3.6010 -1.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8630 -3.2220 -2.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2100 -3.7620 -3.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9280 -4.8070 -2.8920 S 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 0.0250 -0.1670 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -2.6290 2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.6060 -2.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1440 -2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8490 -6.8210 -0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3210 -6.9290 -0.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7120 -6.4800 1.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1530 -7.0330 3.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2660 -7.9560 5.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8780 -11.0060 2.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6150 -12.6270 4.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2520 -12.8500 3.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1640 -12.5920 4.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7910 -10.6190 6.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9020 -11.5370 5.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3270 -9.8880 6.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8380 -3.2370 -0.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6920 -2.5410 -2.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4330 -3.5820 -4.5310 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 7 36 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 25 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 39 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 40 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 20 21 2 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 42 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 25 26 2 0 0 0 0 25 29 1 0 0 0 0 26 27 1 0 0 0 0 26 49 1 0 0 0 0 27 28 2 0 0 0 0 27 50 1 0 0 0 0 28 29 1 0 0 0 0 28 51 1 0 0 0 0 M END