IBS-ZINC04137399 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 60 0 0 1 0 0 0 0 0999 V2000 -0.6270 0.8780 0.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3590 -0.4920 0.3140 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2700 -0.7780 -0.8690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6890 0.1530 -1.8190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3170 -0.2740 -2.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5350 -1.6330 -3.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1280 -2.5750 -2.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4920 -2.1400 -1.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3330 -4.0370 -2.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7040 -4.8220 -1.7590 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2920 -4.5390 -3.5260 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5780 -4.8160 -4.8190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4150 -6.2880 -5.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7820 -6.8060 -5.9180 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1010 -6.8910 -3.9890 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8460 -5.9410 -3.1640 C 0 0 3 0 0 0 0 0 0 0 0 0 2.6740 -6.2030 -2.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3350 -6.0130 -3.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2580 -6.1760 -2.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6110 -6.2410 -2.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0070 -6.1370 -4.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0260 -5.9750 -5.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7030 -5.9190 -4.7710 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1320 -8.3300 -3.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1350 -9.0150 -4.7310 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2910 -11.1930 -5.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1450 -12.7110 -5.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0010 -13.1590 -5.8410 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7930 -12.5950 -5.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8110 -11.0700 -5.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1250 -3.9870 -5.5920 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3020 1.4530 0.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2960 1.3080 -0.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1350 0.9300 1.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5400 1.2180 -1.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6300 0.4590 -3.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0060 -1.9160 -4.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1600 -2.8620 -0.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9450 -6.2530 -1.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3550 -6.3670 -1.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0550 -6.1780 -4.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2830 -5.8820 -6.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3650 -8.5430 -2.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1200 -8.6970 -3.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -8.7200 -5.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1550 -8.7590 -4.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1310 -10.8420 -4.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4040 -10.8630 -6.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0260 -13.1930 -5.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0640 -13.0430 -4.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9610 -12.9930 -5.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6530 -12.9270 -4.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9110 -10.7400 -6.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9120 -10.6430 -4.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1080 -3.8250 -3.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0240 -10.5290 -4.6640 N 0 3 0 0 0 0 0 0 0 0 0 0 2.9370 -10.8040 -3.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 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 35 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 6 7 2 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 38 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 11 55 1 0 0 0 0 12 13 1 0 0 0 0 12 31 2 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 24 1 0 0 0 0 16 17 1 0 0 0 0 16 18 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 39 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 21 22 2 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 25 56 1 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 26 56 1 0 0 0 0 27 28 1 0 0 0 0 27 49 1 0 0 0 0 27 50 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 29 51 1 0 0 0 0 29 52 1 0 0 0 0 30 53 1 0 0 0 0 30 54 1 0 0 0 0 30 56 1 0 0 0 0 56 57 1 0 0 0 0 M CHG 1 56 1 M END