IBS-ZINC04137467 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 58 0 0 1 0 0 0 0 0999 V2000 0.1410 1.6280 0.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1600 0.1300 0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5100 -0.6090 1.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5430 -2.0050 1.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2370 -2.6910 -0.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1030 -1.9420 -1.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1330 -0.5470 -1.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2190 -4.2040 -0.0840 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8890 -4.5440 0.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1690 -4.8530 0.1630 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1020 -6.0630 -0.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0510 -5.9500 -1.6680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2960 -6.7400 -2.5640 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7740 -4.8450 -1.2750 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0150 -4.4520 -1.9390 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2060 -5.3040 -1.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0230 -3.7200 -2.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4670 -6.1580 -2.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8610 -7.0190 -0.7070 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3460 -3.9800 -0.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6960 -3.8590 -1.3950 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0390 -3.1930 0.8230 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2540 -3.6940 2.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8880 -2.8960 3.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3100 -1.6030 2.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1090 -1.1020 1.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4830 -1.9070 0.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4720 0.1390 1.0030 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0750 1.0130 1.9480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1270 2.0220 -0.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6010 2.0310 -0.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1250 1.9870 1.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7490 -0.1000 2.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7990 -2.5480 2.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3700 -2.4390 -2.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4040 0.0090 -2.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8660 -4.5960 -3.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2060 -3.3910 -1.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4940 -5.0710 -0.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9540 -6.3680 -1.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2990 -3.5360 -1.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2840 -2.9960 -2.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9010 -3.6810 -2.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0090 -7.1350 -2.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8080 -6.0630 -1.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2910 -6.0050 -2.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2320 -5.1970 1.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9660 -4.7030 2.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0630 -3.2850 4.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7980 -1.0170 3.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3270 -1.5140 -0.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0280 0.6100 2.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3960 1.2240 2.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2840 1.9600 1.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4260 -5.0980 -2.3610 N 0 3 0 0 0 0 0 0 0 0 0 0 4.1300 -5.2340 -3.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 14 1 0 0 0 0 10 11 1 0 0 0 0 10 20 1 0 0 0 0 10 47 1 0 0 0 0 11 12 1 0 0 0 0 11 19 2 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 16 55 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 17 55 1 0 0 0 0 18 44 1 0 0 0 0 18 45 1 0 0 0 0 18 46 1 0 0 0 0 18 55 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 27 2 0 0 0 0 23 24 2 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 25 26 2 0 0 0 0 25 50 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 27 51 1 0 0 0 0 28 29 1 0 0 0 0 29 52 1 0 0 0 0 29 53 1 0 0 0 0 29 54 1 0 0 0 0 55 56 1 0 0 0 0 M CHG 1 55 1 M END