IBS-ZINC00703020 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 59 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3840 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 1.1970 -0.6910 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3970 0.0090 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3750 1.4160 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1500 2.0940 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7280 1.8370 -0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4920 0.7100 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6890 -0.3770 -0.0340 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9090 0.6820 -0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5380 1.7200 -0.0500 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6360 -0.6390 -0.0630 C 0 0 3 0 0 0 0 0 0 0 0 0 6.9890 -1.0340 -1.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4760 -1.1170 -1.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1100 -1.4110 -2.5300 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0200 -0.8250 -0.3500 N 0 0 0 0 0 0 0 0 0 0 0 0 7.9940 -0.5120 0.6460 C 0 0 3 0 0 0 0 0 0 0 0 0 8.1300 0.5060 1.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0720 -1.4880 1.7910 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8470 -1.0640 3.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9290 -1.9980 4.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2300 -3.3110 3.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4390 -3.6780 2.5540 N 0 0 0 0 0 0 0 0 0 0 0 0 8.3630 -2.8190 1.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4600 -0.8190 -0.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0260 0.5750 -0.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0050 1.9490 -0.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4970 1.9140 0.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1730 1.0510 -0.6890 O 0 0 0 0 0 0 0 0 0 0 0 0 14.6770 -0.2900 -0.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1870 -0.2780 -1.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2180 -1.2420 -2.3880 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9620 1.9080 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9290 -0.5510 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 -1.7710 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1280 3.1730 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0850 2.8560 -0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6130 -0.0310 3.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7600 -1.7030 5.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2970 -4.0440 4.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5350 -3.1580 0.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6360 -1.0810 0.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9530 -1.5470 -0.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8500 0.8370 -1.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5330 1.3020 0.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4770 2.5600 0.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8710 2.3750 -1.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9110 2.9200 0.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6280 1.5400 1.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2210 -0.8790 -1.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8130 -0.7290 0.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0560 0.1120 -2.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7920 -1.2920 -0.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0300 -1.4110 0.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4700 0.5800 -0.0890 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 33 1 0 0 0 0 2 3 2 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 36 1 0 0 0 0 7 8 2 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 12 54 1 0 0 0 0 13 14 1 0 0 0 0 13 32 2 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 25 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 22 23 2 0 0 0 0 22 40 1 0 0 0 0 23 24 1 0 0 0 0 24 41 1 0 0 0 0 25 26 1 0 0 0 0 25 42 1 0 0 0 0 25 43 1 0 0 0 0 26 44 1 0 0 0 0 26 45 1 0 0 0 0 26 55 1 0 0 0 0 27 28 1 0 0 0 0 27 46 1 0 0 0 0 27 47 1 0 0 0 0 27 55 1 0 0 0 0 28 29 1 0 0 0 0 28 48 1 0 0 0 0 28 49 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 30 50 1 0 0 0 0 30 51 1 0 0 0 0 31 52 1 0 0 0 0 31 53 1 0 0 0 0 31 55 1 0 0 0 0 M END