MMs02487418 MOE2007 2D CORINA 3.40 0006 02.08.2006 46 45 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 1.2952 -0.7566 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2560 -1.3566 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2876 -2.2565 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0152 -3.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0132 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6056 1.4868 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3104 2.2434 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9085 2.2302 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.8692 2.8302 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2037 1.4737 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5065 2.2171 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.8017 1.4605 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.1045 2.2039 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3998 1.4474 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.3605 0.8474 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7026 2.1908 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7102 3.6908 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9978 1.4342 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.3006 2.1776 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 15.3399 2.7776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3082 3.6776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5959 1.4211 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8987 2.1645 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6053 1.0362 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0362 0.6053 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6053 -1.0362 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6342 -0.6184 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4277 0.5583 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9704 0.5505 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3379 3.1271 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8805 3.1193 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9917 0.2342 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5082 3.6715 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3143 4.8776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1082 3.6837 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3499 -0.6473 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9583 4.3250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5829 -3.0131 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.5883 -0.0789 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3922 -0.0526 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.4284 -0.6579 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9160 3.7302 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8799 4.3355 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6244 -0.6842 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5768 -4.2131 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 6 1 0 0 0 0 4 5 2 0 0 0 0 4 39 1 0 0 0 0 6 7 1 0 0 0 0 6 28 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 11 1 0 0 0 0 9 43 1 0 0 0 0 11 12 1 0 0 0 0 11 29 1 0 0 0 0 11 30 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 31 1 0 0 0 0 14 32 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 41 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 33 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 23 1 0 0 0 0 22 34 1 0 0 0 0 22 35 1 0 0 0 0 22 36 1 0 0 0 0 23 24 2 0 0 0 0 23 40 1 0 0 0 0 37 41 1 0 0 0 0 38 43 1 0 0 0 0 39 46 1 0 0 0 0 40 45 1 0 0 0 0 41 42 1 0 0 0 0 43 44 1 0 0 0 0 M END