MMs01053888 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 46 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 1.4311 0.4494 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6358 -0.4443 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8580 0.4254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4086 1.8565 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9087 1.8713 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2800 -0.0522 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4046 0.9404 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8265 0.4627 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1238 -1.0075 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9992 -2.0001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5773 -1.5225 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5457 -1.4851 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 10.0234 -0.0632 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0681 -2.9070 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9677 -1.9627 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.0923 -0.9701 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5142 -1.4477 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6388 -0.4551 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3415 1.0151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9195 1.4927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7949 0.5001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6222 2.9630 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.7468 3.9556 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0607 -0.9327 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.1853 0.0599 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3595 1.1449 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1449 -0.3595 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3595 -1.1449 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6240 -1.6442 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1667 2.1166 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7262 1.2568 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2371 -3.1763 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6776 -2.3166 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2055 -3.1389 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7521 -2.6239 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2411 1.8092 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6574 0.8822 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5409 3.0559 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6465 4.7497 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9527 4.8553 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.9794 -0.8398 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.0850 0.8540 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3912 0.9596 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 6 2 0 0 0 0 3 4 2 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 10 11 2 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 12 34 1 0 0 0 0 13 14 2 0 0 0 0 13 15 2 0 0 0 0 13 16 1 0 0 0 0 16 17 1 0 0 0 0 16 35 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 19 25 1 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 23 1 0 0 0 0 22 38 1 0 0 0 0 23 24 1 0 0 0 0 24 39 1 0 0 0 0 24 40 1 0 0 0 0 24 41 1 0 0 0 0 25 26 1 0 0 0 0 26 42 1 0 0 0 0 26 43 1 0 0 0 0 26 44 1 0 0 0 0 M END