IBS-ZINC04994250 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 57 0 0 1 0 0 0 0 0999 V2000 -1.2020 1.5120 1.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4540 2.2460 4.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7730 3.8150 2.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4850 4.0100 1.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3380 5.4650 0.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0200 5.6510 -0.6020 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4230 6.0390 -0.7860 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.0800 5.2940 -0.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6520 6.1000 -2.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4770 5.7740 -2.8670 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4690 5.5020 -1.8210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3140 5.1880 -2.0300 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2590 5.7120 -4.2010 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9040 6.4450 -2.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9740 7.4590 -3.6270 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.0820 5.5610 -2.8310 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9880 4.3680 -2.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0890 3.5450 -1.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2870 3.8980 -2.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3900 5.0810 -3.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2930 5.9180 -3.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5690 5.4220 -3.8910 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.6610 4.5150 -3.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6730 7.3900 -0.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6370 8.2970 -0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8650 9.5360 0.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1300 9.8700 0.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1670 8.9650 0.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9410 7.7250 0.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9550 6.8420 0.1530 F 0 0 0 0 0 0 0 0 0 0 0 0 -1.3810 0.4800 2.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1330 1.7220 2.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5620 1.6600 0.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4040 2.5290 4.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5700 1.2020 4.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0460 2.8780 4.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7160 4.0560 2.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2180 4.4730 3.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0410 3.3520 0.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5430 3.7700 1.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7830 6.1230 1.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2810 5.7050 0.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3560 5.4620 -4.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0540 4.0890 -1.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0160 2.6230 -1.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1460 3.2490 -2.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3730 6.8420 -3.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3960 3.5450 -4.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8810 4.4030 -2.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.5400 4.9060 -4.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6480 8.0370 -0.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0550 10.2440 0.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3080 10.8390 1.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1550 9.2260 1.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9150 2.4180 2.9020 N 0 0 0 0 0 0 0 0 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 55 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 2 55 1 0 0 0 0 3 4 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 3 55 1 0 0 0 0 4 5 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 41 1 0 0 0 0 5 42 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 24 1 0 0 0 0 9 10 2 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 11 12 2 0 0 0 0 13 43 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 19 20 2 0 0 0 0 19 46 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 47 1 0 0 0 0 22 23 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 23 50 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 51 1 0 0 0 0 26 27 1 0 0 0 0 26 52 1 0 0 0 0 27 28 2 0 0 0 0 27 53 1 0 0 0 0 28 29 1 0 0 0 0 28 54 1 0 0 0 0 29 30 1 0 0 0 0 M END