IBS-ZINC04137420 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 53 0 0 1 0 0 0 0 0999 V2000 -3.1300 -0.2200 1.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4260 -1.4730 1.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0950 -1.7010 1.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4300 -2.8540 1.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0870 -3.7760 0.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4160 -3.5590 0.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0780 -2.4060 0.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3470 -4.9740 0.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4560 -5.5080 0.8290 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5480 -5.4370 -1.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7170 -6.7200 -1.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8350 -6.7810 -3.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0150 -7.8160 -3.7190 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7320 -5.4920 -3.5760 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5090 -4.5320 -2.4950 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.3650 -3.8490 -2.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7930 -3.7600 -2.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8280 -2.3980 -2.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0360 -1.7150 -2.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1760 -2.4020 -2.8430 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0590 -3.7530 -3.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9010 -4.4430 -3.0230 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7630 -5.0860 -4.9760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5450 -6.0220 -5.9090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4860 -5.1730 -8.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7470 -6.1980 -8.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8090 -7.8150 -0.8260 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9610 0.5770 1.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2080 -0.3900 1.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7670 0.1120 2.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5690 -0.9850 2.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6000 -3.0230 1.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9600 -4.2810 -0.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1120 -2.2430 0.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0620 -1.8640 -2.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0900 -0.6540 -2.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1310 -1.8960 -2.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9220 -4.3370 -3.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2040 -4.0830 -5.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2780 -5.0100 -5.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0240 -6.9710 -6.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5400 -6.2210 -5.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0270 -6.1330 -8.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1260 -4.4530 -7.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7430 -4.7590 -9.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6810 -6.2620 -7.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3240 -7.1910 -8.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9200 -5.6730 -9.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8920 -8.5860 -1.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7640 -5.3920 -7.2800 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.1980 -4.4700 -7.1320 H 0 0 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 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 33 1 0 0 0 0 7 34 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 2 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 27 1 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 14 23 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 35 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 20 21 2 0 0 0 0 20 37 1 0 0 0 0 21 22 1 0 0 0 0 21 38 1 0 0 0 0 23 24 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 24 41 1 0 0 0 0 24 42 1 0 0 0 0 24 50 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 25 45 1 0 0 0 0 25 50 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 26 50 1 0 0 0 0 27 49 1 0 0 0 0 50 51 1 0 0 0 0 M CHG 1 50 1 M END