MMs01698245 MOE2007 2D CORINA 3.40 0006 02.08.2006 53 55 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 0.0443 -1.4993 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2321 -2.2873 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1698 -1.1165 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7737 0.3302 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5730 -1.6465 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5026 -3.1449 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6734 -4.0825 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0558 -3.5409 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8266 -0.8228 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1668 -1.4965 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2534 -2.9940 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.4203 -0.6728 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.7605 -1.3466 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7346 -2.8463 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8922 -3.8003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3599 -3.4907 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0336 -2.1505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.4056 -0.7887 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9488 -0.4311 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0629 -3.0443 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0548 -4.5443 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3497 -5.3013 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6528 -4.5584 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6609 -3.0584 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3659 -2.3014 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9478 -5.3154 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.1995 0.0354 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0354 1.1995 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1995 -0.0354 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6318 -1.3778 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4878 -2.6144 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6319 -4.6635 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0035 0.0504 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5436 0.1395 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3511 0.5252 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7605 -0.1466 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5693 -2.5596 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1962 -3.9188 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9420 -4.5331 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3951 -4.8898 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3398 -4.6905 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.5251 -3.7774 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.9591 -2.9145 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.9843 -1.4182 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.5797 -0.5411 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4252 0.4111 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0232 0.3325 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4872 0.6413 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9877 -5.1387 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3433 -6.5013 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7034 -2.4640 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3692 -1.7014 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 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 9 1 0 0 0 0 3 21 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 10 35 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 36 1 0 0 0 0 14 15 1 0 0 0 0 14 20 1 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 18 45 1 0 0 0 0 19 20 1 0 0 0 0 19 46 1 0 0 0 0 19 47 1 0 0 0 0 20 48 1 0 0 0 0 20 49 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 50 1 0 0 0 0 23 24 1 0 0 0 0 23 51 1 0 0 0 0 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 52 1 0 0 0 0 26 53 1 0 0 0 0 M END