MMs02616196 MOE2007 2D CORINA 3.40 0006 02.08.2006 40 40 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 0.0359 -1.4996 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0718 -2.9991 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4636 -1.5355 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5355 -1.4636 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2542 -0.1470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4733 1.1337 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7537 -0.1111 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4724 1.2055 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.0724 2.2448 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9720 1.2414 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7529 -0.0393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0342 -1.3559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8151 -2.6366 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3147 -2.6007 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0333 -1.2840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2524 -0.0033 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5329 -1.2481 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 11.3138 -2.5288 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2516 0.0685 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 3.6915 2.4862 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1920 2.4503 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1997 0.0287 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0287 1.1997 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5998 -0.0144 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 -3.0135 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1006 -4.1988 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2715 -2.9704 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4780 -0.9357 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6633 -1.5642 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4493 -2.1353 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3785 -1.1357 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7354 2.4179 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0895 1.6788 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8345 -1.3846 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2402 -3.6899 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9394 -3.6252 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8274 1.0500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4102 3.8029 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7855 4.8274 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 5 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 4 29 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 21 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 15 16 2 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 17 38 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 21 22 2 0 0 0 0 21 39 1 0 0 0 0 39 40 1 0 0 0 0 M CHG 1 18 1 M CHG 1 20 -1 M END