OTAVA-ZINC06143746 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 56 0 0 1 0 0 0 0 0999 V2000 -0.0520 1.4430 0.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9010 0.4080 0.2220 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2920 -0.3380 1.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7640 -0.0760 2.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1570 -0.8300 3.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0880 -1.8620 3.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6170 -2.1220 2.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2140 -1.3660 1.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8610 -1.6920 -0.4650 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2.5110 -2.6690 4.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9110 -2.0620 5.7540 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 -4.0480 4.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9930 -4.9520 5.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7670 -6.3320 4.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0790 -7.3490 5.5650 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1660 -6.2880 3.7780 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9460 -4.8870 3.4070 C 0 0 3 0 0 0 0 0 0 0 0 0 2.4750 -4.6620 2.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4730 -4.6200 3.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0140 -4.0230 2.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3710 -3.7940 1.9680 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2000 -4.1360 2.9350 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7730 -4.7060 4.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4290 -4.9710 4.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7880 -7.4520 2.9730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3660 -7.8830 3.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0280 -9.0990 2.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3900 -9.5120 2.8420 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5470 -9.0720 2.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5620 -9.7040 2.8770 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0390 -10.5080 3.8150 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7390 -10.4020 3.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5160 -4.6580 6.5480 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3590 2.1510 1.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2770 1.9600 -0.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9660 1.0060 0.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0460 0.7200 2.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7470 -0.6250 4.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3360 -2.9160 2.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6600 -3.7400 1.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7580 -3.3290 1.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4810 -4.9720 4.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0860 -5.4420 5.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8300 -7.1910 1.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4790 -8.2710 3.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3250 -8.1440 4.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3240 -7.0640 3.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0130 -8.8380 1.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6620 -9.9180 2.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6300 -8.3550 1.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6120 -9.5840 2.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0540 -10.9360 4.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1690 -2.6750 6.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 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 37 1 0 0 0 0 5 6 1 0 0 0 0 5 38 1 0 0 0 0 6 7 2 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 39 1 0 0 0 0 8 9 1 0 0 0 0 10 11 1 0 0 0 0 10 12 2 0 0 0 0 11 53 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 33 2 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 25 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 22 23 2 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 25 44 1 0 0 0 0 25 45 1 0 0 0 0 26 27 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 27 49 1 0 0 0 0 28 29 1 0 0 0 0 28 32 1 0 0 0 0 29 30 2 0 0 0 0 29 50 1 0 0 0 0 30 31 1 0 0 0 0 30 51 1 0 0 0 0 31 32 2 0 0 0 0 32 52 1 0 0 0 0 M END