MMs01666053 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 45 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 1.4236 -0.4725 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7262 -1.9417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1499 -2.4142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2709 -1.4175 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9683 0.0516 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5447 0.5241 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6945 -1.8900 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.7636 -3.0662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5945 -4.3150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0390 -3.9107 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2152 -4.8416 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1008 -2.4119 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0317 -1.2358 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.6317 -0.1965 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2008 0.0130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7563 -0.3913 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.5305 -1.2976 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2263 -2.6264 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3333 -0.0305 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.8321 -0.0923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1609 0.6035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0991 -0.8952 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3780 1.1389 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1389 0.3780 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3780 -1.1389 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8294 -2.7390 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3920 -3.5895 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8651 0.8489 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3026 1.6995 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9057 -2.2272 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8395 -3.8317 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5315 -4.8717 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0370 -5.4305 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2639 0.5697 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7583 1.1285 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7767 1.0325 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5215 1.0668 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7973 1.7471 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3503 0.7630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6426 -2.0050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2713 -1.1521 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 4 28 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 29 1 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 8 17 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 18 1 0 0 0 0 16 17 1 0 0 0 0 16 35 1 0 0 0 0 16 36 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 22 40 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 M END