IBS-ZINC04084358 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 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 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7070 -0.4900 -1.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1200 -1.1910 -2.0340 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9910 -0.1460 -1.4620 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6770 -0.6180 -2.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0910 -0.0970 -2.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1030 -0.8340 -2.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4000 -0.3580 -2.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6860 0.8610 -2.6970 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6680 1.5990 -3.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3740 1.1160 -3.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9610 1.3320 -2.7060 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1820 2.5940 -3.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3720 -0.5110 0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0290 -0.6550 1.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4810 -0.3650 2.2240 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4420 -1.1770 1.1910 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.5420 -1.9810 0.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4100 -0.0450 0.8440 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8300 -0.4890 1.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8590 0.2400 0.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1730 -0.1300 0.7110 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4660 -1.2340 1.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4420 -1.9610 2.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1200 -1.5910 1.8620 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0380 -2.4210 2.5010 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 2.4610 0.4150 -0.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6920 -1.7080 -2.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1500 -0.2570 -3.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8800 -1.7830 -1.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1900 -0.9350 -1.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8890 2.5490 -3.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5830 1.6880 -3.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2390 2.8520 -3.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8840 2.5330 -4.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5910 3.3600 -2.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8100 -0.7430 -0.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1910 0.8220 1.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2900 0.2240 -0.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6310 1.1030 -0.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9720 0.4410 0.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4930 -1.5260 1.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6720 -2.8230 2.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3330 -2.6760 3.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8990 -3.3370 1.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7720 -1.6830 2.5330 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0260 -2.2570 2.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 16 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 7 34 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 35 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 11 12 2 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 51 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 25 26 2 0 0 0 0 25 47 1 0 0 0 0 26 27 1 0 0 0 0 26 48 1 0 0 0 0 27 28 1 0 0 0 0 28 49 1 0 0 0 0 28 50 1 0 0 0 0 28 51 1 0 0 0 0 51 52 1 0 0 0 0 M END