IBS-ZINC03985030 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 0 0 1 0 0 0 0 0999 V2000 0.5750 0.0610 -0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4980 0.8300 -0.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7880 0.7420 -0.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8050 1.3260 -1.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5260 1.9620 -2.1320 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2460 1.1660 -0.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1700 1.6140 -1.8380 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2350 1.8030 -2.2050 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3020 2.4980 -3.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8420 0.4580 -2.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1680 -0.0420 -3.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1320 -0.8940 -3.9230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2100 -1.1170 -5.2290 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9300 -1.6960 -5.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6180 -0.3960 -6.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5140 0.3130 -5.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4780 1.1430 -5.8130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5440 1.2650 -7.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6610 0.5710 -7.9870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7060 -0.2600 -7.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9910 2.3620 -1.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4410 2.4730 0.0490 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2770 2.7380 -1.1680 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0120 3.2820 -0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4180 3.6220 -0.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7080 4.8820 -0.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9980 5.1950 -1.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9980 4.2470 -1.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7090 2.9860 -0.7260 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4200 2.6760 -0.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6420 -0.9460 -0.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5320 0.5680 -0.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3280 0.0060 1.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0320 0.2220 0.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3890 1.5900 0.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8880 1.6850 -1.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5040 0.1070 -0.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8690 2.0470 -2.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9090 0.5820 -2.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6960 -0.2630 -1.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3590 -1.3380 -3.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1680 1.6870 -5.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2900 1.9080 -7.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7260 0.6770 -9.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 -0.7950 -8.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7170 2.6500 -2.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5120 4.1810 0.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0410 2.5400 0.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9260 5.6230 -1.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2230 6.1790 -1.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0060 4.4900 -1.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4910 2.2460 -0.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1950 1.6920 0.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 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 2 3 2 0 0 0 0 2 7 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 35 1 0 0 0 0 6 36 1 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 21 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 10 40 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 41 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 18 19 2 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 20 45 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 49 1 0 0 0 0 27 28 1 0 0 0 0 27 50 1 0 0 0 0 28 29 2 0 0 0 0 28 51 1 0 0 0 0 29 30 1 0 0 0 0 29 52 1 0 0 0 0 30 53 1 0 0 0 0 M END