MMs02402618 MOE2007 2D CORINA 3.40 0006 02.08.2006 58 60 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 -0.7392 -1.3052 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0216 -2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5215 -2.5855 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2607 -1.2803 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7607 -1.2679 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5214 -2.5606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7822 -3.8659 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2823 -3.8783 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5430 -5.1586 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0429 -5.1462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7821 -3.8409 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2821 -3.8285 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8037 -6.4389 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 8.3036 -6.4265 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0645 -7.7442 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 3.8038 -6.4638 0.0000 N 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 -2.9999 -0.0249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4998 -0.0374 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2390 -1.3426 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4783 -2.6353 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9783 -2.6229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7390 -1.3550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4782 -2.6602 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.4997 -0.0623 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.9997 -0.0747 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -8.3997 0.9645 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7389 -1.3799 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2388 -1.3924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9780 -2.6976 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2173 -3.9904 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.7604 1.2181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0213 2.5233 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0442 -0.5914 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5914 1.0442 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0442 0.5914 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1026 -3.0178 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2397 -3.7780 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6521 -0.2461 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8907 -4.8627 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8734 -2.7843 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6038 -6.4738 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4124 -7.4981 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4085 1.0193 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1085 0.9969 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0696 -3.6795 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3697 -3.6571 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9084 0.9819 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6079 -1.7810 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9374 -2.5634 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0403 -0.2089 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.3698 -0.9913 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0214 -2.5482 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -13.4780 -2.7101 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.2604 1.2056 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.8690 2.2398 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.0693 -3.7542 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 3 1 0 0 0 0 2 18 1 0 0 0 0 3 4 1 0 0 0 0 3 38 1 0 0 0 0 3 39 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 40 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 54 2 0 0 0 0 8 9 1 0 0 0 0 8 10 2 0 0 0 0 10 11 1 0 0 0 0 10 17 1 0 0 0 0 11 12 2 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 12 54 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 17 43 1 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 45 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 47 1 0 0 0 0 23 48 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 49 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 27 33 1 0 0 0 0 29 30 1 0 0 0 0 29 50 1 0 0 0 0 29 51 1 0 0 0 0 30 31 1 0 0 0 0 30 52 1 0 0 0 0 30 53 1 0 0 0 0 31 32 2 0 0 0 0 31 55 1 0 0 0 0 33 34 2 0 0 0 0 33 56 1 0 0 0 0 55 58 1 0 0 0 0 56 57 1 0 0 0 0 M CHG 1 14 1 M CHG 1 16 -1 M END