OTAVA-ZINC05485940 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 56 0 0 0 0 0 0 0 0999 V2000 0.8190 0.0780 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1430 -1.2630 -0.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3490 -1.1190 -0.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9520 -1.4510 1.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3200 -1.3190 1.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0900 -0.8540 0.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4930 -0.5200 -1.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1180 -0.6460 -1.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5090 -0.3040 -2.3900 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1530 -0.5250 -3.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2910 -0.9440 -3.5470 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4590 -0.2500 -4.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3630 -0.5680 -5.9710 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1880 0.3900 -6.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0050 0.1510 -7.4480 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.0790 -1.0660 -8.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2630 -2.0940 -7.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3690 -1.8080 -6.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6270 -2.6720 -6.0600 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4720 -3.3320 -8.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3930 -3.2520 -9.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0830 -1.6430 -9.3530 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.7250 -4.5780 -8.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8520 -5.1110 -8.9650 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1580 -6.2700 -8.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3270 -6.9050 -7.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1910 -6.3810 -6.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8860 -5.2190 -6.7890 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8230 -4.6460 -5.7560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5670 -8.1710 -7.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8980 -0.0270 -0.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4500 0.8300 -0.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5900 0.3850 1.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3710 -1.5700 -1.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5110 -2.0160 0.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3540 -1.8140 1.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7900 -1.5790 2.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1590 -0.7520 0.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0940 -0.1580 -1.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6240 0.0930 -2.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1800 0.8020 -4.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5640 -0.8680 -4.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1640 1.3790 -6.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6760 -4.0710 -9.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7200 -4.6170 -9.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4820 -6.6840 -9.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3190 -6.8810 -5.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8190 -5.0640 -5.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4620 -4.8990 -4.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8640 -3.5620 -5.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3860 -7.9220 -6.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1510 -8.7950 -6.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3860 -8.7130 -8.0990 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 34 1 0 0 0 0 2 35 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 36 1 0 0 0 0 5 6 1 0 0 0 0 5 37 1 0 0 0 0 6 7 2 0 0 0 0 6 38 1 0 0 0 0 7 8 1 0 0 0 0 7 39 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 40 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 41 1 0 0 0 0 12 42 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 14 15 2 0 0 0 0 14 43 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 22 1 0 0 0 0 17 18 1 0 0 0 0 17 20 1 0 0 0 0 18 19 2 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 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 46 1 0 0 0 0 26 27 2 0 0 0 0 26 30 1 0 0 0 0 27 28 1 0 0 0 0 27 47 1 0 0 0 0 28 29 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