MMs00565969 MOE2007 2D CORINA 3.40 0006 02.08.2006 40 42 0 0 1 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 0.8225 -1.2544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1474 -2.5939 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3201 -1.1693 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.1315 0.0922 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5821 -0.2896 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7436 0.6595 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6671 -1.7872 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2691 -2.3309 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.1177 -3.1794 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8873 -3.7815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4401 -4.1761 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0582 -5.6266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1235 -6.6826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5707 -6.2881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9526 -4.8375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7417 -8.1332 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 5.9287 -2.5986 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2622 -1.9118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5238 -2.7232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9218 -2.1795 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8709 -3.3411 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.0690 -3.2730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0595 -4.6027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6089 -4.2208 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5878 1.4902 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0035 0.6580 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6580 1.0035 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0035 -0.6580 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5879 -3.3313 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0995 -5.9423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4230 -7.1329 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1103 -4.5218 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1142 -3.4798 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6551 -3.5538 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5359 -0.9566 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0768 -1.0306 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2273 -1.0191 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4944 -5.7211 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7201 -0.1301 0.0000 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 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 1 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 26 2 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 18 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 30 1 0 0 0 0 13 14 1 0 0 0 0 13 31 1 0 0 0 0 14 15 2 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 32 1 0 0 0 0 16 33 1 0 0 0 0 18 19 1 0 0 0 0 18 34 1 0 0 0 0 18 35 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 19 37 1 0 0 0 0 20 21 2 0 0 0 0 20 25 1 0 0 0 0 21 22 1 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 24 25 2 0 0 0 0 24 39 1 0 0 0 0 M END