MMs01079558 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 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 -1.5000 -0.0075 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2434 -1.3103 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4869 -2.6056 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0131 -2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7565 -1.2952 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7696 -3.8933 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 0.0261 -5.1961 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2696 -3.8857 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -3.7434 -1.3179 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4999 -0.0226 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9999 -0.0302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7434 -1.3330 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7564 1.2651 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.2564 1.2575 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9999 -0.0453 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4999 -0.0528 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2564 1.2424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5129 2.5452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0130 2.5528 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.7564 1.2349 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -12.7639 2.7349 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.7488 -0.2651 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -14.2564 1.2273 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -15.0129 2.5226 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.4097 3.8960 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -15.5294 4.8940 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.8247 4.1375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.5054 2.6719 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 0.5948 1.0422 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1052 1.0287 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0817 -3.6478 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9565 -1.2892 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3382 -2.3601 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9052 1.0196 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1617 2.3073 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3947 -1.0815 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0946 -1.0950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1182 3.5814 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4182 3.5950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.8511 0.1851 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.4100 6.0881 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.9234 4.6201 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 30 1 0 0 0 0 2 3 2 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 10 1 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 7 1 0 0 0 0 6 33 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 10 11 2 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 20 40 1 0 0 0 0 21 22 2 0 0 0 0 21 23 2 0 0 0 0 21 24 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 25 26 2 0 0 0 0 25 29 1 0 0 0 0 26 27 1 0 0 0 0 27 28 2 0 0 0 0 27 42 1 0 0 0 0 28 29 1 0 0 0 0 28 43 1 0 0 0 0 M CHG 1 7 1 M CHG 1 9 -1 M END