CHEMDIV-ZINC04168532 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 60 0 0 1 0 0 0 0 0999 V2000 0.5230 1.0380 -0.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5200 -0.4700 0.0560 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2030 -0.7610 1.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3660 -0.1610 2.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8630 0.5620 3.3340 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1100 -0.4880 2.5450 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.2450 -1.5410 2.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7100 -0.2070 1.1630 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.6550 0.8610 0.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9230 -0.9770 0.1010 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.3890 -0.8300 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9280 -2.4450 0.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5800 -2.8480 1.3740 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2060 -3.3060 -0.2950 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2580 -4.7050 0.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6070 -5.5150 -0.8430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4170 -6.4240 -0.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1500 -0.6500 1.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0120 -0.1470 0.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3320 -0.5510 0.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7950 -1.4640 1.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9260 -1.9670 2.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6060 -1.5630 2.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1300 -1.8740 1.0790 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.0220 -1.4110 0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6370 -2.7680 2.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7910 0.3690 3.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6790 1.1200 3.2540 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4090 0.2990 4.8650 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1090 1.1540 5.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5490 0.9410 7.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2830 1.9700 7.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2260 -1.1340 -0.9940 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5510 1.3990 -0.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 1.2450 -1.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0160 1.5450 0.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2830 -1.8380 1.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1970 -0.3130 1.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1060 -4.8150 1.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2870 -5.0600 0.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5580 -5.3450 -1.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0370 -7.0030 -1.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4660 -6.5930 0.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6520 0.5620 -0.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0050 -0.1580 -0.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2830 -2.6760 2.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9290 -1.9570 2.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9850 -2.1100 -0.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0420 -1.3530 0.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7040 -0.4240 -0.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8240 -3.0400 2.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4200 -2.2590 2.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0470 -3.6670 1.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9770 2.1970 5.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1700 0.9080 5.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3680 -0.0610 7.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4650 2.9720 7.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8820 1.8170 8.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1500 -0.8620 -1.0800 H 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 10 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 37 1 0 0 0 0 3 38 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 8 1 0 0 0 0 6 27 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 18 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 16 17 2 0 0 0 0 16 41 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 26 51 1 0 0 0 0 26 52 1 0 0 0 0 26 53 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 30 54 1 0 0 0 0 30 55 1 0 0 0 0 31 32 2 0 0 0 0 31 56 1 0 0 0 0 32 57 1 0 0 0 0 32 58 1 0 0 0 0 33 59 1 0 0 0 0 M END