CHEMDIV-ZINC06943241 MOE2007 3D CORINA 3.40 0006 02.08.2006 62 64 0 0 0 0 0 0 0 0999 V2000 3.5600 0.5470 0.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1410 0.4660 0.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1610 0.0760 -0.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0730 -0.5530 1.8990 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9020 -1.4640 1.9690 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0390 -0.4390 2.8280 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9720 -1.4050 3.9290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4040 -2.0750 4.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4120 -0.0470 2.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0150 0.5850 2.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8840 -1.6210 4.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9010 -0.6750 4.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1990 -0.6380 4.3610 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.7000 0.3430 5.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7910 0.9140 5.9250 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5860 0.2330 5.7310 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.0690 0.9100 5.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9080 0.3310 6.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2960 0.9510 6.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6170 1.8290 5.4740 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.1630 0.4830 7.2630 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.8500 -0.5730 8.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.5060 1.0630 7.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.5680 0.1620 6.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.4480 -0.5430 7.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.4230 -1.3800 7.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.5290 -1.5230 5.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.6590 -0.8300 4.8350 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.6830 0.0080 5.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8720 -0.4030 -0.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6240 1.3210 -0.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2800 0.7950 0.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9010 1.4610 1.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4150 -0.9030 -0.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1340 0.0080 0.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1780 0.8110 -1.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7420 -2.1770 3.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1760 -0.8520 4.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6120 -2.6760 3.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4800 -2.6970 4.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1750 0.7230 3.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6350 -0.6230 2.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1620 1.2050 3.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0310 1.2440 1.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7820 -2.4570 4.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1790 -2.0190 3.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0070 2.0020 5.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5510 0.7040 4.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0100 -0.7530 6.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4090 0.5200 7.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0850 -0.2180 9.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4620 -1.4500 7.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8020 -0.8710 8.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7150 1.2810 8.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5460 2.0290 6.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.3780 -0.4460 8.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.1020 -1.9220 7.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.2880 -2.1750 5.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.7370 -0.9420 3.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.0110 0.5450 4.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4900 -1.0150 4.0940 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.3400 -0.4660 4.9560 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 4 1 0 0 0 0 2 33 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 7 38 1 0 0 0 0 8 39 1 0 0 0 0 8 40 1 0 0 0 0 8 61 1 0 0 0 0 9 10 1 0 0 0 0 9 41 1 0 0 0 0 9 42 1 0 0 0 0 9 61 1 0 0 0 0 10 43 1 0 0 0 0 10 44 1 0 0 0 0 11 12 1 0 0 0 0 11 45 1 0 0 0 0 11 46 1 0 0 0 0 11 61 1 0 0 0 0 12 13 1 0 0 0 0 12 16 2 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 17 18 1 0 0 0 0 17 47 1 0 0 0 0 17 48 1 0 0 0 0 18 19 1 0 0 0 0 18 49 1 0 0 0 0 18 50 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 51 1 0 0 0 0 22 52 1 0 0 0 0 22 53 1 0 0 0 0 23 24 1 0 0 0 0 23 54 1 0 0 0 0 23 55 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 56 1 0 0 0 0 26 27 1 0 0 0 0 26 57 1 0 0 0 0 27 28 2 0 0 0 0 27 58 1 0 0 0 0 28 29 1 0 0 0 0 28 59 1 0 0 0 0 29 60 1 0 0 0 0 61 62 1 0 0 0 0 M CHG 1 61 1 M END