MMs01846862 MOE2007 2D CORINA 3.40 0006 02.08.2006 47 50 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 1.2925 -0.7612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2796 -2.2611 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5721 -3.0223 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8776 -2.2835 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8905 -0.7835 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 -0.0447 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4885 -0.8059 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4756 -2.3058 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7939 -0.0671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0865 -0.8283 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 10.3919 -0.0895 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5616 1.4009 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.0314 1.7001 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.7702 0.3947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7569 -0.7114 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.0562 -2.1812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9328 -3.1753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0768 -4.6684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7013 -5.2666 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7072 -4.1433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4684 -2.8508 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2606 0.2250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1527 1.4309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6430 1.2613 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 17.2413 -0.1142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3492 -1.3201 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8589 -1.1505 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6089 1.0340 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0340 0.6089 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6089 -1.0340 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2353 -2.8521 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5618 -4.2222 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9116 -2.8924 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6083 1.1776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2063 1.1552 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0305 0.8587 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5732 0.8455 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1726 -1.7413 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6833 -3.2043 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1108 -5.2773 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4417 -6.4382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5127 -4.2585 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6740 2.5313 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.4336 -0.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8279 -2.4205 0.0000 H 0 0 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 5 6 2 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 16 24 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 19 20 2 0 0 0 0 19 23 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 21 22 2 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 45 1 0 0 0 0 26 27 1 0 0 0 0 27 28 2 0 0 0 0 27 46 1 0 0 0 0 28 29 1 0 0 0 0 28 47 1 0 0 0 0 M END