MMs02530359 MOE2007 2D CORINA 3.40 0006 02.08.2006 62 67 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 1.1897 -0.9136 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6229 0.2752 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1809 -1.0734 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.2201 -0.4734 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1816 -2.5371 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6238 -2.9513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9884 -4.4032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9108 -5.4467 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4683 -5.0351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1015 -3.5829 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1847 -2.3047 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7214 -1.9967 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3537 -3.1201 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4159 -4.6188 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2111 -1.7813 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6403 -1.3259 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7493 -2.3360 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1785 -1.8806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4987 -0.4152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3897 0.5949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9605 0.1395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9279 0.0402 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2481 1.5057 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.0369 -0.9698 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.7167 -2.4352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8257 -3.4452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2549 -2.9898 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.5751 -1.5244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4661 -0.5144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3639 -3.9999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.7931 -3.5445 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.9020 -4.5545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.5818 -6.0199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1526 -6.4753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3655 0.4759 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4759 0.3655 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7309 -0.9517 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1366 0.6266 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5645 1.0191 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4864 -2.1171 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1424 -4.7323 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2026 -6.6106 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6070 -5.8706 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2254 -1.2595 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4931 -3.5083 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0657 -2.6886 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6459 1.7672 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5169 0.5435 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6066 -1.9794 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0750 -3.4492 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8759 -4.1786 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3830 -4.5080 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6851 -1.9803 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2168 -0.5104 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9088 0.5483 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4159 0.2190 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.0492 -2.3721 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.0454 -4.1902 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.4690 -6.8279 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8964 -7.6477 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0436 -5.4653 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 1 0 0 0 0 2 12 1 0 0 0 0 2 16 1 0 0 0 0 3 4 1 0 0 0 0 3 39 1 0 0 0 0 3 40 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 13 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 41 1 0 0 0 0 8 9 1 0 0 0 0 8 42 1 0 0 0 0 9 10 2 0 0 0 0 9 43 1 0 0 0 0 10 11 1 0 0 0 0 10 44 1 0 0 0 0 11 12 1 0 0 0 0 13 14 1 0 0 0 0 13 45 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 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 46 1 0 0 0 0 19 20 1 0 0 0 0 19 47 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 48 1 0 0 0 0 22 49 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 30 1 0 0 0 0 26 27 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 27 28 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 28 29 1 0 0 0 0 28 31 1 0 0 0 0 29 30 1 0 0 0 0 29 54 1 0 0 0 0 29 55 1 0 0 0 0 30 56 1 0 0 0 0 30 57 1 0 0 0 0 31 32 1 0 0 0 0 31 62 2 0 0 0 0 32 33 2 0 0 0 0 32 58 1 0 0 0 0 33 34 1 0 0 0 0 33 59 1 0 0 0 0 34 35 2 0 0 0 0 34 60 1 0 0 0 0 35 61 1 0 0 0 0 35 62 1 0 0 0 0 M END