CHEMDIV-ZINC06781706 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 52 0 0 0 0 0 0 0 0999 V2000 0.0020 1.3770 0.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -0.0520 0.0440 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1880 -0.6800 0.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2460 -2.0670 0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4670 -2.7080 0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6440 -1.9620 0.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5830 -0.5690 0.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3590 0.0660 0.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9590 -2.6480 0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1720 -2.0540 0.0710 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.0480 -3.0410 0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3470 -4.1840 0.0540 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1590 -3.9410 0.0430 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.4170 -2.9210 0.0790 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.0610 -4.2400 0.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5760 -4.0690 -0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0960 -3.2330 1.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3740 -1.8820 1.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8650 -2.1170 1.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.5780 -3.0100 0.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.1620 -3.4740 -0.0060 O 0 0 0 0 0 0 0 0 0 0 0 0 -13.2550 -2.2950 1.8710 N 0 0 0 0 0 0 0 0 0 0 0 0 -14.6100 -2.0050 1.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.4450 -2.9240 1.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.7780 -2.5920 0.8730 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.2330 -1.3680 1.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.4160 -0.5190 1.9200 N 0 0 0 0 0 0 0 0 0 0 0 0 -15.1420 -0.7990 2.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0260 1.7510 0.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5210 1.7420 -0.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5090 1.7290 0.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3340 -2.6450 0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5110 -3.7870 0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4930 0.0120 0.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3110 1.1450 0.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6850 -4.8230 -0.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8360 -4.7600 1.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8030 -3.5620 -1.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0550 -5.0480 -0.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9040 -3.7580 2.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5980 -1.3410 0.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7100 -1.2990 1.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6410 -2.6460 2.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3480 -1.1580 1.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.8020 -1.9820 2.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.0620 -3.8730 0.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.4550 -3.2800 0.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 -18.2720 -1.1030 1.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.5040 -0.0800 2.6030 H 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 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 9 13 2 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 14 15 1 0 0 0 0 14 19 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 20 1 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 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 28 49 1 0 0 0 0 M END