MMs01019281 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 46 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 -0.0112 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2402 -1.3159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7402 -1.3271 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 -0.0337 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7596 1.2709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2597 1.2821 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5194 2.5868 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 5.9998 -0.0449 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7401 -1.3496 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9804 -2.6429 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2400 -1.3608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9803 -2.6654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4802 -2.6767 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2400 -1.3833 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.4997 -0.0787 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9997 -0.0674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7399 -1.3945 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 12.7287 -2.8945 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7511 0.1055 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2399 -1.4057 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1124 -2.6258 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5424 -2.1730 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 17.5080 -2.8856 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.5537 -0.6731 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1306 -0.1989 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0090 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0090 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0090 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6324 -2.3506 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3324 -2.3708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3674 2.3056 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6076 0.9898 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6400 -2.4000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8496 -3.0674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1798 -3.8487 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2630 -3.8568 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6048 -3.0955 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6304 0.3233 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3002 1.1046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8752 0.3514 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2170 1.1128 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7331 -3.7643 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.5298 0.0250 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 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 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 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 18 19 2 0 0 0 0 18 20 2 0 0 0 0 18 21 1 0 0 0 0 21 22 2 0 0 0 0 21 26 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 25 26 2 0 0 0 0 25 44 1 0 0 0 0 M END