MMs02059663 MOE2007 2D CORINA 3.40 0006 02.08.2006 54 56 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 1.5000 0.0019 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2516 -1.2962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7516 -1.2943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 0.0057 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7484 1.3038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2484 1.3019 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 0.0076 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7516 -1.2905 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0033 -2.5905 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2516 -1.2886 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0000 0.0114 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0033 -2.5867 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.5033 -2.5848 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2549 -3.8829 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.0958 -4.1935 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6465 -5.2540 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7625 -6.2563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0606 -5.5046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7469 -4.0378 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.7492 -2.9218 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 14.8652 -3.9241 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.6332 -1.9195 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.7515 -1.8058 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2861 -0.3799 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2884 0.7361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7560 0.4261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2214 -0.9999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2191 -2.1159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.7583 1.5421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0015 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0015 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0015 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6530 -2.3362 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3529 -2.3328 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3470 2.3438 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6470 2.3404 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5987 1.0476 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4046 -3.6267 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2934 -1.4033 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6304 -2.1730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6065 -4.6553 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9424 -6.2257 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8718 -7.0604 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4691 -7.2262 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5501 -6.6003 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2014 -5.1324 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1120 -0.1318 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9162 1.8769 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.3955 -1.2479 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.5913 -3.2567 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.6511 0.7403 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.5602 2.4349 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8655 2.3439 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 9 10 2 0 0 0 0 9 11 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 39 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 20 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 18 45 1 0 0 0 0 19 20 1 0 0 0 0 19 46 1 0 0 0 0 19 47 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 23 2 0 0 0 0 21 24 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 48 1 0 0 0 0 26 27 1 0 0 0 0 26 49 1 0 0 0 0 27 28 2 0 0 0 0 27 30 1 0 0 0 0 28 29 1 0 0 0 0 28 50 1 0 0 0 0 29 51 1 0 0 0 0 30 52 1 0 0 0 0 30 53 1 0 0 0 0 30 54 1 0 0 0 0 M END