IBS-ZINC04295548 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 53 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0200 -0.3840 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7500 -0.5150 1.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1700 0.0650 1.2610 C 0 0 3 0 0 0 0 0 0 0 0 0 2.1250 1.1310 1.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7830 -0.1350 -0.0520 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0890 -0.3910 -1.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9430 -0.5160 -2.1670 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1880 -0.3450 -1.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1320 -0.1090 -0.4070 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3580 -0.4080 -2.4620 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2880 -0.6580 -3.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2090 -0.8290 -4.3120 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5490 -0.7260 -4.6070 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1910 -1.0210 -6.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4520 -1.0890 -6.8870 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1090 -2.2950 -7.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2660 -2.3570 -7.8010 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7650 -1.2140 -8.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1070 -0.0080 -8.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9480 0.0530 -7.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7000 -0.4830 -1.2070 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9860 -0.6380 2.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5340 0.0820 3.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2830 -0.5620 4.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4840 -1.9280 4.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9350 -2.6490 3.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1820 -2.0040 2.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2180 -0.2070 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8040 -1.6040 1.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2210 -0.2720 -2.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0730 0.2270 -4.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1900 -1.5190 -4.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6660 -1.9740 -6.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5490 -0.2280 -6.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7190 -3.1880 -6.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7800 -3.2990 -7.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6690 -1.2620 -8.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4980 0.8850 -8.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4320 0.9940 -7.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2180 -0.8430 -1.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3780 1.1490 3.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7120 0.0000 5.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0690 -2.4320 5.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0920 -3.7150 3.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7500 -2.5680 1.4260 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 4 1 0 0 0 0 2 23 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 24 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 2 0 0 0 0 8 23 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 16 39 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 40 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 20 21 2 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 22 44 1 0 0 0 0 23 45 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 46 1 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 27 28 2 0 0 0 0 27 48 1 0 0 0 0 28 29 1 0 0 0 0 28 49 1 0 0 0 0 29 50 1 0 0 0 0 M END