CHEMDIV-ZINC04972012 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 61 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 3 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 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 0.7630 -2.0410 1.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4790 -2.5340 -0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7390 -2.0270 -1.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7180 -0.4980 -1.2570 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7410 -0.1200 -1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0100 -0.0120 -2.4440 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6690 0.1320 -3.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8490 -0.1400 -3.6770 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0600 0.6310 -4.8310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9120 0.7020 -6.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1760 1.2430 -7.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0110 0.4110 -7.4860 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9650 0.2030 -6.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2050 -0.3260 -5.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2680 -0.2770 -8.9700 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.6650 -0.5160 -9.0650 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5490 0.5120 -9.9080 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4920 -1.8590 -8.9530 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2430 -2.9890 -9.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6500 -4.2500 -9.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7000 -4.3860 -8.9290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5060 -3.2420 -8.8230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9060 -1.9580 -8.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6700 -0.8650 -8.7440 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9740 -0.9520 -8.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6270 -2.1820 -8.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9050 -3.3390 -8.7040 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 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 1.2900 -2.4020 2.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2600 -2.4180 1.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5020 -2.1570 -0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4940 -3.6240 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2490 -2.3790 -2.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2840 -2.4050 -1.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9340 0.2050 -2.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4630 1.6240 -4.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7400 1.3660 -5.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2960 -0.2950 -6.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1310 2.2730 -7.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8350 1.2020 -8.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4460 1.1480 -6.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7190 -0.5240 -6.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8010 -1.3130 -5.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8840 -0.3940 -4.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3160 -2.9070 -9.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2700 -5.1310 -9.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1480 -5.3690 -8.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5570 -0.0460 -8.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7030 -2.2220 -8.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3950 -4.3010 -8.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 8 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 37 1 0 0 0 0 5 38 1 0 0 0 0 6 7 1 0 0 0 0 6 39 1 0 0 0 0 6 40 1 0 0 0 0 7 8 1 0 0 0 0 7 41 1 0 0 0 0 7 42 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 43 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 13 44 1 0 0 0 0 14 15 1 0 0 0 0 14 45 1 0 0 0 0 14 46 1 0 0 0 0 15 16 1 0 0 0 0 15 47 1 0 0 0 0 15 48 1 0 0 0 0 16 17 1 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 49 1 0 0 0 0 17 50 1 0 0 0 0 18 51 1 0 0 0 0 18 52 1 0 0 0 0 19 20 2 0 0 0 0 19 21 2 0 0 0 0 19 22 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 53 1 0 0 0 0 24 25 2 0 0 0 0 24 54 1 0 0 0 0 25 26 1 0 0 0 0 25 55 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 28 29 1 0 0 0 0 29 30 2 0 0 0 0 29 56 1 0 0 0 0 30 31 1 0 0 0 0 30 57 1 0 0 0 0 31 58 1 0 0 0 0 M END