OTAVA-ZINC05374927 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 49 0 0 1 0 0 0 0 0999 V2000 -2.5490 -0.2420 -2.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9340 -1.1730 -1.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0580 -0.6130 -0.5470 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.7710 0.4130 -0.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3850 -0.5190 -1.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1950 -1.4280 0.7680 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.2050 -1.5760 1.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0420 -0.5910 1.7770 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2150 -1.0400 1.9690 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7940 -2.7560 0.5700 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1060 -3.8940 0.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8870 -3.9470 0.0730 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0120 -5.1150 0.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2630 -6.2000 -0.5600 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5790 -7.0980 0.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6270 -7.1220 1.4710 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8030 -8.0460 -0.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9510 -8.9930 -0.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5230 -9.3160 1.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6190 -10.6400 1.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1520 -11.0000 2.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5840 -10.0410 3.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4670 -8.7220 3.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9300 -8.3630 2.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0500 -10.4320 5.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1480 -7.7770 -2.2510 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.1650 -6.3810 -1.9250 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8580 -5.4790 -3.1460 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.6850 -0.6480 -3.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3620 -0.1310 -3.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2780 0.7500 -2.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2290 -2.1380 -1.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0380 -1.3460 -0.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3040 0.1740 -2.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6890 -1.4930 -1.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1920 -0.1450 -0.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7960 -2.7620 0.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3440 -5.4150 1.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8910 -4.8520 -0.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4840 -9.6300 -0.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0560 -11.4050 0.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2340 -12.0360 3.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0110 -7.9620 3.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8230 -7.3300 1.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9970 -10.7380 5.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1180 -9.5970 5.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6270 -11.2610 5.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4640 0.4120 2.2800 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 34 1 0 0 0 0 5 35 1 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 10 1 0 0 0 0 8 9 2 0 0 0 0 8 48 1 0 0 0 0 10 11 1 0 0 0 0 10 37 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 38 1 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 14 27 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 2 0 0 0 0 17 26 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 24 44 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 26 27 1 0 0 0 0 27 28 2 0 0 0 0 M CHG 1 48 -1 M END