OTAVA-ZINC04615790 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 60 0 0 0 0 0 0 0 0999 V2000 -0.2410 1.6310 0.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0410 0.3850 0.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1960 -0.2240 0.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2500 0.4100 -0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0520 1.6720 -0.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7940 2.2750 -0.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1640 2.3560 -1.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2290 1.7880 -1.4470 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 3.6110 -1.7630 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4990 -0.2020 -0.1010 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5960 -1.5440 -0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5930 -2.2250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9520 -2.2000 0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7820 -3.7180 0.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1590 -4.3840 0.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9880 -5.9020 0.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3650 -6.5670 0.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1950 -8.0860 0.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5710 -8.7510 0.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4040 -10.2460 0.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2920 -10.7320 0.5330 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4880 -11.0440 0.5790 N 0 0 0 0 0 0 0 0 0 0 0 0 9.3350 -12.4150 0.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2030 -12.9090 1.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0530 -14.2680 1.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0280 -15.1490 1.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1580 -14.6770 0.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3210 -13.3040 0.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5260 -12.7930 -0.3630 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7100 -11.5950 -0.4540 O 0 0 0 0 0 0 0 0 0 0 0 0 12.4220 -13.6540 -0.8840 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2130 2.0970 0.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8580 -0.1120 1.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3430 -1.1950 1.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6340 3.2460 -0.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1500 4.0640 -1.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 4.0610 -2.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2990 0.3370 -0.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5150 -1.9450 -0.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4920 -1.8470 0.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2200 -3.9730 1.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2420 -4.0710 -0.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7210 -4.1290 -0.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6980 -4.0300 1.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4260 -6.1560 1.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4490 -6.2550 -0.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9280 -6.3130 -0.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9050 -6.2140 1.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6320 -8.3400 1.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6550 -8.4390 -0.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1340 -8.4960 -0.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1110 -8.3980 1.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3760 -10.6630 0.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4390 -12.2290 1.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1710 -14.6470 2.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9020 -16.2100 1.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9150 -15.3680 0.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2750 -14.6100 -0.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2140 -13.3180 -1.3320 H 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 32 1 0 0 0 0 2 3 2 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 4 5 2 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 35 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 36 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 38 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 15 16 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 16 45 1 0 0 0 0 16 46 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 1 0 0 0 0 19 51 1 0 0 0 0 19 52 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 53 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 54 1 0 0 0 0 25 26 1 0 0 0 0 25 55 1 0 0 0 0 26 27 2 0 0 0 0 26 56 1 0 0 0 0 27 28 1 0 0 0 0 27 57 1 0 0 0 0 28 29 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 31 58 1 0 0 0 0 31 59 1 0 0 0 0 M END