IBS-ZINC06664005 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 59 0 0 0 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 -1.1990 -0.6370 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2500 -2.0260 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4670 -2.6710 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6500 -1.9280 0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5940 -0.5320 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3730 0.1060 0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9560 -2.6160 0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0030 -3.8310 0.0300 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0960 -1.8970 0.0510 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.3920 -2.5800 0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5150 -1.5420 0.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8490 -2.2440 0.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8960 -3.4560 0.0800 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.9890 -1.5250 0.1010 N 0 0 0 0 0 0 0 0 0 0 0 0 -12.2960 -2.1960 0.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.1150 -1.6640 1.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.1880 -0.1390 1.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.7810 0.4520 1.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9480 -0.0570 0.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.0270 0.3910 2.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.9580 1.3590 2.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.5140 1.5820 3.4080 N 0 0 0 0 0 0 0 0 0 0 0 0 -16.2140 2.2200 3.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.9040 0.7430 4.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.0160 0.0350 3.6300 N 0 0 0 0 0 0 0 0 0 0 0 0 -15.2580 2.0180 0.8670 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.1020 1.7000 -0.0920 C 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 -0.3350 -2.5990 -0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5060 -3.7500 0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5060 0.0460 0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3290 1.1850 0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0580 -0.9280 0.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4830 -3.1990 -0.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4650 -3.2090 0.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4250 -0.9230 0.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4420 -0.9120 -0.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.8200 -1.9870 -0.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.1540 -3.2710 0.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.1220 -2.0790 1.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.6380 -1.9560 2.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8400 1.5400 1.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3110 0.1470 2.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9170 0.2790 0.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3610 0.3300 -0.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.1170 0.6710 5.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.1910 1.6260 0.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.3390 3.0970 1.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.3800 1.9920 -1.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.2140 2.2520 0.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.8170 0.2580 -0.0600 N 0 0 0 0 0 0 0 0 0 0 0 0 -13.2480 -0.0150 -0.8470 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 9 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 8 36 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 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 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 18 45 1 0 0 0 0 19 20 1 0 0 0 0 19 22 1 0 0 0 0 19 55 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 20 47 1 0 0 0 0 21 48 1 0 0 0 0 21 49 1 0 0 0 0 22 23 2 0 0 0 0 22 27 1 0 0 0 0 23 24 1 0 0 0 0 23 28 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 26 27 2 0 0 0 0 26 50 1 0 0 0 0 28 29 1 0 0 0 0 28 51 1 0 0 0 0 28 52 1 0 0 0 0 29 53 1 0 0 0 0 29 54 1 0 0 0 0 29 55 1 0 0 0 0 55 56 1 0 0 0 0 M END