CHEMDIV-ZINC04952138 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 60 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 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 0.5500 -1.9430 1.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2370 -2.3970 2.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8210 -0.5790 2.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1350 -0.1250 1.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3690 -2.5180 3.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8540 -2.3450 3.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5390 -1.2820 3.9170 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8260 -1.4560 3.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9460 -2.7180 3.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6770 -3.2630 3.0390 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2980 -4.5880 2.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9290 -4.4900 1.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5390 -5.8530 0.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2210 -6.2640 0.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8630 -7.5140 0.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8240 -8.3530 -0.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1420 -7.9420 -0.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4990 -6.6900 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2160 -3.1640 2.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3460 -4.2660 2.1140 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2840 -2.3550 2.7730 N 0 0 0 0 0 0 0 0 0 0 0 0 10.1590 -2.6570 2.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1540 -1.1360 3.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1390 -0.4340 3.4500 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9610 -0.6720 3.7410 N 0 0 0 0 0 0 0 0 0 0 0 0 7.8620 0.6620 4.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 -2.4510 0.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5110 -2.1880 1.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7650 -1.9100 3.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1420 -3.4790 2.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8820 -0.3340 2.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3680 -0.0700 3.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2290 0.9570 1.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6070 -0.6120 0.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1440 -3.5740 3.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0490 -1.9490 4.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1360 -5.2750 2.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4420 -4.9570 3.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0910 -3.8030 0.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7850 -4.1220 0.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4700 -5.6090 1.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8330 -7.8360 0.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5440 -9.3300 -0.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8920 -8.5980 -0.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5280 -6.3670 -0.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0070 0.5910 5.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6290 1.3090 3.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8770 1.0810 4.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7130 -0.4910 1.1920 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6590 -2.0310 2.5860 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 2 56 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 3 56 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 4 57 1 0 0 0 0 5 6 1 0 0 0 0 5 38 1 0 0 0 0 5 39 1 0 0 0 0 5 57 1 0 0 0 0 6 40 1 0 0 0 0 6 41 1 0 0 0 0 6 56 1 0 0 0 0 7 8 1 0 0 0 0 7 42 1 0 0 0 0 7 43 1 0 0 0 0 7 57 1 0 0 0 0 8 9 2 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 27 1 0 0 0 0 11 12 1 0 0 0 0 11 21 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 44 1 0 0 0 0 13 45 1 0 0 0 0 14 15 1 0 0 0 0 14 46 1 0 0 0 0 14 47 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 48 1 0 0 0 0 17 18 1 0 0 0 0 17 49 1 0 0 0 0 18 19 2 0 0 0 0 18 50 1 0 0 0 0 19 20 1 0 0 0 0 19 51 1 0 0 0 0 20 52 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 28 53 1 0 0 0 0 28 54 1 0 0 0 0 28 55 1 0 0 0 0 M END