MMs02052837 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 45 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 1.4999 -0.0125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2391 -1.3177 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4783 -2.6105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2175 -3.9157 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7174 -3.9282 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4782 -2.6354 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7391 -1.3302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4998 -0.0374 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7607 1.2678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9782 -2.6479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7173 -3.9531 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7390 -1.3552 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2389 -1.3676 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1307 -0.1615 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.5533 -0.6369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5408 -2.1368 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1105 -2.5885 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 11.7741 0.2347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7866 1.7346 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.2170 2.1863 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8385 3.5515 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3315 3.6958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2031 2.4750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5816 1.1098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0886 0.9654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1968 -0.2407 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0100 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0100 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2784 -2.6005 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6089 -4.9499 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3088 -4.9724 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8049 1.8591 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1693 2.3120 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7165 0.6765 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1476 -0.3110 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5058 -2.8502 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1413 4.5281 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8287 4.7880 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.3975 2.5905 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.2788 0.1332 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 7 2 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 14 15 2 0 0 0 0 14 18 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 19 20 2 0 0 0 0 19 27 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 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 2 0 0 0 0 24 41 1 0 0 0 0 25 26 1 0 0 0 0 25 42 1 0 0 0 0 26 27 1 0 0 0 0 M END