IBS-ZINC06664037 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 0 0 0 0 0 0999 V2000 -3.9570 -5.2160 0.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6810 -3.9480 -0.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8890 -3.6100 -1.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3550 -2.7520 0.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4110 -2.2920 1.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5140 -2.8120 1.4870 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9320 -1.2180 2.1190 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.6000 -0.5150 3.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8970 0.5410 3.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4490 1.3130 4.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7420 0.9830 5.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4690 -0.0570 4.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8960 -0.8190 3.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7100 -0.1700 5.2010 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.7500 0.7740 6.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5890 1.4970 6.1430 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.3200 2.6060 7.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6550 3.9520 6.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3850 5.0930 7.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1200 5.6950 7.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8630 6.7360 8.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8650 7.1810 9.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1250 6.5870 9.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3840 5.5460 8.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4180 -4.1610 -1.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2850 -5.2420 -2.5370 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2730 -6.0010 -2.7170 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1550 -6.0850 -0.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1010 -5.4620 0.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8310 -5.1030 0.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7960 -3.4340 -0.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6990 -2.7090 -2.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1250 -4.4200 -2.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4540 -2.9930 0.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1070 -1.8750 -0.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9950 -0.8980 1.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8890 0.7850 3.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8900 2.1250 5.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4830 -1.6220 3.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5860 0.9770 6.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9110 2.4460 7.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2650 2.5510 7.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0750 4.0950 5.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7070 3.9760 6.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3250 5.3600 6.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8800 7.1980 8.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6640 7.9910 9.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9070 6.9330 9.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3730 5.0920 8.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2070 -3.2150 -1.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5620 -4.3260 -0.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1660 -5.2340 -3.1280 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 25 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 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 4 35 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 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 16 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 13 39 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 18 44 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 45 1 0 0 0 0 21 22 1 0 0 0 0 21 46 1 0 0 0 0 22 23 2 0 0 0 0 22 47 1 0 0 0 0 23 24 1 0 0 0 0 23 48 1 0 0 0 0 24 49 1 0 0 0 0 25 26 1 0 0 0 0 25 50 1 0 0 0 0 25 51 1 0 0 0 0 26 27 2 0 0 0 0 26 52 1 0 0 0 0 M CHG 1 52 -1 M END