OTAVA-ZINC05374855 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 45 0 0 1 0 0 0 0 0999 V2000 0.0470 2.0020 0.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0940 0.1900 0.6680 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.6610 -0.2600 0.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7940 -1.7830 0.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2740 -2.1630 0.4260 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.7350 -1.6490 -0.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4010 -3.6520 0.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9930 -4.3160 1.0550 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9470 -1.7680 1.6660 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.2730 -1.5250 1.6650 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9080 -1.6320 0.6380 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9660 -1.1190 2.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3920 -0.9140 2.6780 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.2420 -1.9200 2.7980 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8920 -3.0390 3.1250 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.6430 -1.5850 2.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.7230 -2.4040 2.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0740 -1.8480 2.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.1320 -2.6760 1.9910 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.3960 -2.1470 1.8380 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.6200 -0.8000 2.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.5780 0.0260 2.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.3090 -0.4890 2.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5950 0.1400 2.0900 S 0 0 0 0 0 0 0 0 0 0 0 0 -7.8450 0.2920 2.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9100 1.7130 2.1180 S 0 0 0 0 0 0 0 0 0 0 0 0 1.0640 2.3900 0.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4360 2.3880 -0.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5150 2.3180 1.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1800 0.1120 1.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1010 0.1820 -0.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2750 -2.1550 -0.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3530 -2.2250 1.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4390 -1.6820 2.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8430 -1.9040 3.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5280 -0.1930 3.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5910 -3.4650 2.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.9600 -3.7260 1.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.2140 -2.7840 1.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.6120 -0.3920 1.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.7600 1.0750 2.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4990 0.1560 2.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8560 -4.2410 -0.8380 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9630 -5.1990 -0.9160 H 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 3 4 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 7 8 2 0 0 0 0 7 43 1 0 0 0 0 9 10 1 0 0 0 0 9 34 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 35 1 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 13 25 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 16 24 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 21 22 2 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 43 44 1 0 0 0 0 M END