IFLAB-ZINC04850842 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 61 0 0 1 0 0 0 0 0999 V2000 -0.4960 1.2960 0.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2260 -0.1270 0.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1950 -1.1320 1.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -2.4630 0.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2060 -2.8160 -0.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1660 -1.8050 -1.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0540 -0.4750 -0.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4360 -4.2770 -0.7520 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3800 -4.8940 0.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8370 -4.4570 -1.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9420 -3.9260 -0.6240 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2730 -4.4600 0.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6520 -5.3850 1.1180 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4620 -3.7770 1.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7800 -4.3590 2.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9860 -3.6950 3.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8420 -2.5700 4.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9640 -1.9430 4.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2400 -2.4330 4.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3950 -3.5490 3.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2740 -4.1770 2.9540 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0680 -4.6700 -1.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1760 -5.1920 -1.9340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6570 -6.7650 -2.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4950 -6.2840 -2.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0440 -7.0830 -3.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1120 1.5080 1.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0020 1.9900 0.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5730 1.4900 0.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3360 -0.8840 2.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -3.2180 1.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3080 -2.0280 -2.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0850 0.2940 -1.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0560 -5.5190 -1.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8780 -3.9700 -2.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4830 -3.1480 -0.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3210 -3.8880 0.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2420 -2.7050 1.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9170 -4.2470 3.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9570 -5.4400 2.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8540 -2.1740 4.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8450 -1.0730 5.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1130 -1.9440 4.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3900 -3.9300 3.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4090 -5.0440 2.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2340 -3.6070 -0.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0420 -5.2200 -0.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1320 -5.0900 -1.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2280 -4.5580 -2.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6320 -6.2220 -3.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4910 -7.8260 -3.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4110 -6.8740 -1.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4320 -6.3460 -2.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1060 -6.5280 -4.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0080 -7.0000 -2.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9020 -8.1450 -3.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6920 -4.8270 -1.6640 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.7060 -4.2600 -2.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9600 -6.5970 -2.3010 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 57 1 0 0 0 0 10 11 1 0 0 0 0 10 34 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 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 19 20 2 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 21 45 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 22 57 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 23 59 1 0 0 0 0 24 25 1 0 0 0 0 24 50 1 0 0 0 0 24 51 1 0 0 0 0 24 59 1 0 0 0 0 25 52 1 0 0 0 0 25 53 1 0 0 0 0 25 57 1 0 0 0 0 26 54 1 0 0 0 0 26 55 1 0 0 0 0 26 56 1 0 0 0 0 26 59 1 0 0 0 0 57 58 1 0 0 0 0 M CHG 1 57 1 M END