MMs01291272 MOE2007 2D CORINA 3.40 0006 02.08.2006 40 41 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 -1.5000 0.0109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2593 -1.2827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5188 -2.5871 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0188 -2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7406 -1.3044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7218 -3.9024 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2217 -3.9133 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9811 -2.6197 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9623 -5.2177 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4623 -5.2286 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2028 -6.5330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4435 -7.8266 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.7028 -6.5439 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.4434 -7.8483 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9433 -7.8592 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6839 -9.1636 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7027 -6.5656 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.2027 -6.5765 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9433 -7.8809 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4432 -7.8918 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2026 -6.5982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4620 -5.2937 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9621 -5.2829 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2215 -3.9785 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -2.2782 -3.8807 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.6075 1.0349 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0924 1.0544 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4593 -1.2740 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9405 -1.3131 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1143 -4.9373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3548 -6.2526 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0698 -4.1937 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3103 -5.5090 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8359 -8.8832 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1103 -5.5221 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3358 -8.9158 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0357 -8.9353 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4026 -6.6069 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0695 -4.2589 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 37 1 0 0 0 0 21 22 1 0 0 0 0 21 38 1 0 0 0 0 22 23 2 0 0 0 0 22 39 1 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 M END