MMs01229613 MOE2007 2D CORINA 3.40 0006 02.08.2006 36 37 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 0.0085 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2863 -2.2573 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3118 -2.2426 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6065 -1.4853 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.6065 -2.6853 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9803 -2.0876 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3005 -3.5530 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9776 -0.9672 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2203 0.3276 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8226 1.7013 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.7549 0.0074 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4703 -1.1156 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3451 0.1029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8377 -0.0454 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7125 1.1731 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0947 2.5399 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6020 2.6883 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7272 1.4698 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 0.0068 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0068 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0068 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0307 -0.9000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8922 -1.2215 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3221 -2.8632 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6804 -3.2931 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5456 -3.1662 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0883 -3.1575 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8586 0.8053 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1461 -2.2709 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5518 -1.6355 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3320 -1.1389 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9066 1.0544 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7945 3.5147 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1077 3.7818 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5331 1.5885 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 23 1 0 0 0 0 3 24 1 0 0 0 0 3 25 1 0 0 0 0 3 26 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 12 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 13 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 29 1 0 0 0 0 13 14 1 0 0 0 0 13 30 1 0 0 0 0 13 31 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 32 1 0 0 0 0 16 17 1 0 0 0 0 16 33 1 0 0 0 0 17 18 2 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 19 36 1 0 0 0 0 M END