OTAVA-ZINC05485964 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 56 0 0 0 0 0 0 0 0999 V2000 -0.5410 0.5840 0.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3700 -0.9040 0.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2410 -1.7100 1.7230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0830 -3.0740 1.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0540 -3.6380 0.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1840 -2.8210 -0.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3470 -1.4590 -0.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1530 -3.4240 -2.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1160 -5.1020 0.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7890 -5.9850 0.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2810 -7.6270 0.2190 S 0 0 0 0 0 0 0 0 0 0 0 0 1.2170 -7.0830 -0.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2830 -5.6950 -0.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4340 -5.0690 -1.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5460 -3.8550 -1.0610 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3940 -5.8460 -1.6030 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2630 -7.1970 -1.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2280 -7.7860 -1.0810 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5840 -5.2290 -2.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6490 -5.0800 -1.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4340 -5.4530 -0.0030 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8400 -4.5330 -1.4530 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7870 -4.2940 -0.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3740 -3.9440 0.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3120 -3.7080 1.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6600 -3.8200 1.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0750 -4.1680 0.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1420 -4.4110 -0.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5450 -4.2880 -0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8650 -3.3280 3.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4370 1.0640 0.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1300 0.9760 -0.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0560 0.7890 1.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2640 -1.2720 2.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -3.7020 2.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4520 -0.8260 -1.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1660 -3.6900 -2.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2580 -2.6990 -2.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4710 -4.3170 -2.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7160 -5.7230 1.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0440 -7.8000 -2.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9590 -5.8600 -3.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3260 -4.2470 -2.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0400 -4.3060 -2.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3210 -3.8560 1.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3910 -3.6350 2.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4660 -4.6870 -1.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8730 -5.3100 0.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7200 -4.0380 -1.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1060 -3.6030 0.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7300 -4.2290 3.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6200 -2.6940 3.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9210 -2.7860 3.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 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 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 36 1 0 0 0 0 8 37 1 0 0 0 0 8 38 1 0 0 0 0 8 39 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 40 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 18 1 0 0 0 0 13 14 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 19 1 0 0 0 0 17 18 2 0 0 0 0 17 41 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 19 43 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 44 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 45 1 0 0 0 0 25 26 1 0 0 0 0 25 30 1 0 0 0 0 26 27 2 0 0 0 0 26 46 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 28 47 1 0 0 0 0 29 48 1 0 0 0 0 29 49 1 0 0 0 0 29 50 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 30 53 1 0 0 0 0 M END