IBS-ZINC05266673 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 56 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 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.5340 0.0130 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.4190 -1.6200 0.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1250 -0.1370 -1.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1220 0.5520 -1.2280 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6350 -0.5490 -2.4520 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3070 -0.1630 -3.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3060 -0.1830 -4.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8330 -1.2190 -5.8790 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3510 -1.3000 -5.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4070 -1.1880 -4.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1550 0.0340 1.1540 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0670 -0.5500 2.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3910 -1.5460 2.5110 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8090 0.0340 3.5400 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.7950 0.3700 3.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0230 1.2170 4.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6260 1.6530 5.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2950 2.9050 5.9140 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8220 3.3420 7.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6830 2.5270 7.8230 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0140 1.2810 7.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4860 0.8410 6.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8840 -0.5230 5.6240 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 0.7570 -1.6010 1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8370 -1.1000 -2.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7410 0.8310 -3.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2540 0.8020 -5.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3200 -0.4790 -4.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6590 -0.8760 -6.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3600 -2.1870 -5.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8800 -0.4680 -6.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7590 -2.2540 -5.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1890 -2.1520 -3.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3830 -0.8230 -3.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6960 0.8310 1.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9870 0.9190 4.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0560 2.0460 3.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6220 3.5420 5.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5620 4.3190 7.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0970 2.8650 8.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6860 0.6450 7.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8790 -1.2280 6.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8860 -0.4730 5.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9520 -0.9850 4.5910 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2500 -1.8670 4.2020 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 4 1 0 0 0 0 2 5 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 15 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 42 1 0 0 0 0 14 43 1 0 0 0 0 15 16 1 0 0 0 0 15 44 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 53 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 20 46 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 47 1 0 0 0 0 23 24 1 0 0 0 0 23 48 1 0 0 0 0 24 25 2 0 0 0 0 24 49 1 0 0 0 0 25 26 1 0 0 0 0 25 50 1 0 0 0 0 26 27 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 53 54 1 0 0 0 0 M END