MMs03210415 MOE2007 2D CORINA 3.40 0006 02.08.2006 54 54 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 1.3049 -0.7397 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0205 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9029 -0.7192 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.9421 -1.3192 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9148 -2.2192 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6217 -2.9794 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3168 -2.2397 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6335 -4.4793 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3405 -5.2396 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 0.0410 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5009 -0.6987 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1841 1.5410 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9637 2.4131 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4159 3.8433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9159 3.8551 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3907 2.4322 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.2392 3.2808 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8209 1.9800 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1443 0.5153 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9276 2.9925 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.6689 4.1642 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3578 2.5402 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.0472 3.6993 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6813 1.0755 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1115 0.6232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5745 0.0630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4646 3.5527 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8948 3.1004 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5918 1.0439 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0439 0.5918 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5918 -1.0439 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5409 -1.6650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0835 -1.6528 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8194 0.9337 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9800 0.4832 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0948 -2.0014 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3341 -3.3435 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6775 -5.0711 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3499 -6.4395 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6678 1.8911 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8636 2.8925 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2402 4.0835 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5319 5.0376 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7810 5.0475 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0877 4.1139 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9919 -0.0836 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7497 -0.5209 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2556 0.2615 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4733 1.7674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7645 0.9484 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6891 -0.7469 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3845 -0.8224 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1411 5.0174 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 11 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 6 38 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 39 1 0 0 0 0 10 40 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 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 15 16 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 16 45 1 0 0 0 0 16 46 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 28 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 47 1 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 28 29 2 0 0 0 0 28 54 1 0 0 0 0 M CHG 1 54 -1 M END