IBS-ZINC02112898 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 51 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6060 -0.6080 -1.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1670 0.1610 -2.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7740 -0.4470 -3.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8240 -1.8180 -3.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2830 -2.6120 -2.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6650 -1.9960 -1.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1220 -2.7500 -0.1340 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2480 -3.1280 -0.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5360 -4.0240 -2.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1000 -4.9730 -1.9240 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3210 -4.1160 -3.6390 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3450 -2.7720 -4.2730 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7760 -2.7310 -5.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1500 -2.5480 -4.5220 S 0 0 0 0 0 0 0 0 0 0 0 0 4.4600 -4.3170 -4.9160 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2020 -5.0290 -4.3730 C 0 0 3 0 0 0 0 0 0 0 0 0 3.5120 -5.8340 -3.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4390 -5.6230 -5.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2820 -5.3120 -5.7140 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0430 -6.4990 -6.3560 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3000 -7.0760 -7.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2100 -8.0320 -8.2540 C 0 0 3 0 0 0 0 0 0 0 0 0 3.5600 -8.8260 -7.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4400 -8.6390 -9.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2720 -8.2280 -10.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6580 -7.9260 -10.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3320 -7.3120 -8.7900 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1300 1.2380 -2.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2090 0.1580 -3.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3660 -3.7120 -1.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5560 -3.7260 0.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8670 -2.2320 -0.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5480 -4.4620 -5.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3540 -4.6740 -4.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9680 -6.7470 -6.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4370 -7.6230 -7.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9640 -6.2780 -8.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3970 -9.7250 -9.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4360 -8.2200 -9.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3380 -9.0500 -11.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8550 -7.3380 -11.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2190 -8.8470 -9.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2200 -7.2350 -10.6870 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 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 6 7 2 0 0 0 0 6 14 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 29 1 0 0 0 0 26 27 1 0 0 0 0 26 43 1 0 0 0 0 26 44 1 0 0 0 0 27 28 1 0 0 0 0 27 45 1 0 0 0 0 27 46 1 0 0 0 0 28 29 1 0 0 0 0 28 47 1 0 0 0 0 28 48 1 0 0 0 0 M END