MMs00485301 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 43 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 -0.8408 -1.2422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0809 -2.4257 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4912 -1.9149 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4412 -0.4157 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3880 0.3216 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3399 -1.2922 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0462 -2.6155 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.6462 -1.5763 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5454 -2.6655 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3383 -1.3921 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2517 -3.9888 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.7509 -4.0388 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.1509 -5.0780 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5437 -2.7654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0429 -2.8154 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8358 -1.5421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3349 -1.5920 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -12.1278 -0.3187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.6270 -0.3687 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.4572 -5.3621 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9563 -5.4120 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4086 1.1283 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4850 -2.5875 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1710 -0.1041 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4806 -0.9196 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6174 -5.0074 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4304 -2.3177 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7914 -1.5913 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7953 -3.9896 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1562 -3.2632 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7224 -1.0943 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0834 -0.3679 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.9000 -2.6507 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.2612 0.6500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.1920 -1.4273 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8184 -4.9475 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4215 1.0046 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -12.0558 2.0233 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6643 -6.6354 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2534 -3.8888 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0540 -3.8489 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2294 -7.6940 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 5 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 7 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 4 24 1 0 0 0 0 5 6 1 0 0 0 0 7 8 1 0 0 0 0 7 25 1 0 0 0 0 7 26 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 41 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 27 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 21 1 0 0 0 0 15 16 1 0 0 0 0 15 28 1 0 0 0 0 15 29 1 0 0 0 0 16 17 1 0 0 0 0 16 30 1 0 0 0 0 16 31 1 0 0 0 0 17 18 1 0 0 0 0 17 32 1 0 0 0 0 17 33 1 0 0 0 0 18 19 1 0 0 0 0 18 34 1 0 0 0 0 19 20 1 0 0 0 0 19 38 2 0 0 0 0 20 35 1 0 0 0 0 20 36 1 0 0 0 0 21 22 2 0 0 0 0 21 40 1 0 0 0 0 37 41 1 0 0 0 0 38 39 1 0 0 0 0 40 43 1 0 0 0 0 41 42 1 0 0 0 0 M END