MMs00872995 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 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 -0.0061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2447 -1.3082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7447 -1.3143 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -0.0184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7553 1.2837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2553 1.2898 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9999 -0.0245 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.7446 -1.3266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2446 -1.3327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9999 -0.0368 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4999 -0.0429 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2552 1.2531 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2446 -1.3450 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.4446 -1.3499 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4893 -2.6410 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9893 -2.6348 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.2340 -3.9430 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.7340 -3.9492 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6206 -2.7393 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.0453 -3.2086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3474 -2.4639 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.6433 -3.2192 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.6372 -4.7192 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3351 -5.4639 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0392 -4.7086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6107 -5.1663 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0049 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0049 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0049 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6404 -2.3450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3404 -2.3560 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3595 2.3205 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6595 2.3315 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6153 -1.7324 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9482 -2.5092 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4042 1.0049 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6297 -4.9798 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3523 -1.2639 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.6850 -2.6235 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.6740 -5.3235 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3302 -6.6639 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 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 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 9 36 1 0 0 0 0 10 11 2 0 0 0 0 10 17 1 0 0 0 0 11 12 1 0 0 0 0 11 37 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 16 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 19 20 2 0 0 0 0 19 27 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 39 1 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 24 25 2 0 0 0 0 24 41 1 0 0 0 0 25 26 1 0 0 0 0 25 42 1 0 0 0 0 26 27 1 0 0 0 0 M END