MMs00029666 MOE2007 2D CORINA 3.40 0006 02.08.2006 65 68 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 -0.8562 -1.2316 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3631 -2.6482 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5580 -3.5550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7896 -2.6988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3559 -1.2629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2626 -0.0680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6812 1.3147 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7508 -0.2558 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.4736 -1.5702 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9470 -1.2890 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1349 0.1992 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.9834 -0.6493 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7775 0.8377 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.6184 1.1483 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4963 2.3111 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0797 2.8043 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.6317 3.2914 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.0921 2.9490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8690 4.2322 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8887 5.3675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5060 4.7861 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.8166 5.9452 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2229 5.5630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2541 7.0627 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9085 4.8402 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.4492 0.9220 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.7324 0.1451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7011 -1.3546 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.0467 0.8679 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -12.3299 0.0910 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.2986 -1.4087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.5818 -2.1856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.8961 -1.4628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.9274 0.0368 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.6443 0.8137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.2418 0.7596 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -17.5249 -0.0173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9853 -0.6850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6850 0.9853 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9853 0.6850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7857 -2.9952 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5330 -4.7548 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9229 -3.0933 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3674 -2.0353 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8206 -2.7190 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0476 -2.4848 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1468 -1.3140 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6976 1.8157 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1779 2.4382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8249 3.5067 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6904 5.1070 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8741 6.0525 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3105 6.4190 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8835 3.6405 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8820 5.4618 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4742 2.1217 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0717 2.0676 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2471 -1.9869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.5568 -3.3854 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.9226 -2.0844 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.6693 2.0135 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -18.1464 1.0092 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -18.5514 -0.6388 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.9034 -1.0438 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 39 1 0 0 0 0 1 40 1 0 0 0 0 1 41 1 0 0 0 0 2 3 1 0 0 0 0 2 6 1 0 0 0 0 3 4 2 0 0 0 0 3 42 1 0 0 0 0 4 5 1 0 0 0 0 4 43 1 0 0 0 0 5 6 2 0 0 0 0 5 44 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 10 45 1 0 0 0 0 10 46 1 0 0 0 0 11 12 1 0 0 0 0 11 47 1 0 0 0 0 11 48 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 27 1 0 0 0 0 14 15 1 0 0 0 0 14 16 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 22 1 0 0 0 0 19 20 1 0 0 0 0 19 49 1 0 0 0 0 19 50 1 0 0 0 0 20 21 1 0 0 0 0 20 51 1 0 0 0 0 20 52 1 0 0 0 0 21 22 1 0 0 0 0 21 53 1 0 0 0 0 21 54 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 55 1 0 0 0 0 26 56 1 0 0 0 0 27 28 1 0 0 0 0 27 57 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 30 31 1 0 0 0 0 30 58 1 0 0 0 0 31 32 1 0 0 0 0 31 36 2 0 0 0 0 32 33 2 0 0 0 0 32 59 1 0 0 0 0 33 34 1 0 0 0 0 33 60 1 0 0 0 0 34 35 2 0 0 0 0 34 61 1 0 0 0 0 35 36 1 0 0 0 0 35 37 1 0 0 0 0 36 62 1 0 0 0 0 37 38 1 0 0 0 0 38 63 1 0 0 0 0 38 64 1 0 0 0 0 38 65 1 0 0 0 0 M END