OTAVA-ZINC02889355 MOE2007 3D CORINA 3.40 0006 02.08.2006 68 72 0 0 0 0 0 0 0 0999 V2000 0.4590 1.4090 -0.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2300 -0.0690 -0.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3170 -0.6330 0.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1060 -1.9890 1.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1910 -2.7810 0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2790 -2.2180 -1.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0730 -0.8610 -1.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1740 -0.2460 -2.7830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6580 -3.2280 -2.6380 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.2920 -2.4790 -3.7890 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1360 -4.5180 -2.3520 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3050 -3.3920 -2.6920 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1500 -2.2200 -2.9380 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5410 -2.6720 -3.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4860 -2.8580 -2.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7610 -3.2720 -2.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0960 -3.5020 -3.9720 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1380 -3.3120 -4.9680 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8680 -2.8930 -4.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4600 -3.9460 -4.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2930 -4.1110 -3.4590 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.7810 -4.1670 -5.6190 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.0930 -4.4900 -5.9670 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6270 -4.0310 -7.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9220 -4.3480 -7.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.6990 -5.1330 -6.6570 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.1600 -5.5930 -5.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8630 -5.2770 -5.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.0890 -5.4750 -7.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.8870 -6.1910 -6.3060 N 0 0 0 0 0 0 0 0 0 0 0 0 -16.1260 -6.4160 -6.7750 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.1740 -7.1580 -6.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 -18.3750 -7.2780 -6.8150 C 0 0 0 0 0 0 0 0 0 0 0 0 -18.5960 -6.6750 -8.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.5930 -5.9460 -8.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.3570 -5.8110 -8.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.8940 -4.9570 -8.4990 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.4200 -4.2600 0.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2020 -2.6030 2.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5160 1.5920 -0.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1300 1.7670 -1.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1560 1.9380 0.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5490 -0.0130 1.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8030 -0.2710 -3.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8900 -0.8090 -3.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5080 0.7880 -2.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7100 -4.2630 -2.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1910 -1.6060 -2.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7310 -1.6360 -3.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2260 -2.6800 -1.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4980 -3.4170 -1.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3900 -3.4880 -6.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1260 -2.7410 -5.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0990 -4.1010 -6.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0260 -3.4240 -7.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.3360 -3.9900 -8.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.7590 -6.2000 -4.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4440 -5.6360 -4.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.0210 -7.6340 -5.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 -19.1660 -7.8490 -6.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 -19.5540 -6.7790 -8.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.7650 -5.4780 -9.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4900 -4.4600 0.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -4.8010 -0.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0480 -4.5880 1.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7770 -2.5780 2.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5370 -3.6370 2.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9150 -2.0390 3.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 40 1 0 0 0 0 1 41 1 0 0 0 0 1 42 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 43 1 0 0 0 0 4 5 1 0 0 0 0 4 39 1 0 0 0 0 5 6 2 0 0 0 0 5 38 1 0 0 0 0 6 7 1 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 8 44 1 0 0 0 0 8 45 1 0 0 0 0 8 46 1 0 0 0 0 9 10 2 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 12 13 1 0 0 0 0 12 47 1 0 0 0 0 13 14 1 0 0 0 0 13 48 1 0 0 0 0 13 49 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 50 1 0 0 0 0 16 17 1 0 0 0 0 16 51 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 52 1 0 0 0 0 19 53 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 54 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 55 1 0 0 0 0 25 26 1 0 0 0 0 25 56 1 0 0 0 0 26 27 2 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 57 1 0 0 0 0 28 58 1 0 0 0 0 29 30 2 0 0 0 0 29 37 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 31 36 2 0 0 0 0 32 33 2 0 0 0 0 32 59 1 0 0 0 0 33 34 1 0 0 0 0 33 60 1 0 0 0 0 34 35 2 0 0 0 0 34 61 1 0 0 0 0 35 36 1 0 0 0 0 35 62 1 0 0 0 0 36 37 1 0 0 0 0 38 63 1 0 0 0 0 38 64 1 0 0 0 0 38 65 1 0 0 0 0 39 66 1 0 0 0 0 39 67 1 0 0 0 0 39 68 1 0 0 0 0 M END