OTAVA-ZINC05372666 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 45 0 0 0 0 0 0 0 0999 V2000 0.4520 0.5500 -0.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7070 1.3700 0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9620 0.5350 0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2740 -0.2430 1.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4230 -1.0090 1.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2660 -0.9970 0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9490 -0.2130 -1.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8010 0.5540 -1.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4300 -1.7710 0.0440 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0340 -2.1050 1.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6940 -1.6830 2.4260 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.3620 -2.0830 3.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0820 -1.7160 4.6180 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.4700 -3.0030 3.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3320 -3.5790 4.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1060 -3.4380 5.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9060 -3.5050 6.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0980 -3.3260 7.5100 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.3930 -3.3320 8.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4370 -3.1350 7.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1290 -3.1890 6.5610 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5100 -3.0200 6.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1940 -2.7960 7.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5120 -2.7380 8.9150 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1460 -2.9130 8.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4280 -3.1810 1.4390 S 0 0 0 0 0 0 0 0 0 0 0 0 1.3600 1.1530 -0.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6050 -0.3380 0.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2160 0.2500 -1.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4710 1.6690 1.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8600 2.2580 -0.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6190 -0.2520 2.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6660 -1.6180 2.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6020 -0.2020 -1.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5560 1.1660 -1.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8100 -2.0730 -0.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1810 -4.1400 3.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9500 -3.6740 5.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0430 -3.0630 5.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.2660 -2.6640 7.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0580 -2.5620 9.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6240 -2.8660 9.9030 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 2 30 1 0 0 0 0 2 31 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 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 10 11 2 0 0 0 0 10 26 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 14 26 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 16 17 2 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 23 24 2 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 25 42 1 0 0 0 0 M END