MMs01985845 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 45 0 0 0 0 0 0 0 0999 V2000 0.0000 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3039 0.7415 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9019 0.7245 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 -0.0340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5000 0.7075 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7941 -0.0510 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0980 0.6905 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3921 -0.0680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3823 -1.5680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0783 -2.3095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7842 -1.5510 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6764 -2.3265 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.9803 -1.5850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9901 -0.0850 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2744 -2.3435 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.5783 -1.6020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5881 -0.1020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8920 0.6395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1861 -0.1190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1763 -1.6190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8724 -2.3605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4704 -2.3775 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.5932 1.0431 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0431 -0.5932 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5932 -1.0431 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5386 1.6658 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0813 1.6557 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8207 -0.9312 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3633 -0.9413 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1366 1.6488 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6793 1.6387 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4187 -0.9482 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9614 -0.9583 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1058 1.8904 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4352 0.5252 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0705 -3.5094 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7411 -2.1442 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6685 -3.5264 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2665 -3.5435 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5528 0.5048 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8999 1.8394 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.2293 0.4742 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8646 -3.5605 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 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 5 34 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 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 13 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 39 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 40 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 20 21 2 0 0 0 0 20 43 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 44 1 0 0 0 0 M END