MMs02169654 MOE2007 2D CORINA 3.40 0006 02.08.2006 58 61 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 0.7595 1.2935 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2594 1.2825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9999 -0.0219 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2404 -1.3155 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7405 -1.3045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 -0.0329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2594 1.2606 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7593 1.2496 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4998 -0.0548 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5188 2.5432 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.9187 3.9179 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0408 4.9134 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3343 4.1539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0117 2.6890 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.1708 2.9996 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0072 1.5670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5333 0.1439 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.4767 1.8681 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.4722 0.7461 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 12.7828 1.9052 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9416 1.0472 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9372 -0.0748 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6146 -1.5397 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9081 -2.2992 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 16.0248 -3.4935 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.0301 -1.3037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4301 0.0711 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3206 1.2781 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.8112 1.1104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4112 -0.2643 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.5207 -1.4714 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9982 -0.6770 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9938 -1.7991 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0088 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1671 2.3371 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8670 2.3174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8328 -2.3590 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1329 -2.3393 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2829 -1.2131 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6245 -0.4516 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8751 3.3255 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2205 4.8939 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1549 5.7229 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7532 5.8791 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8304 5.2466 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4728 3.7748 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8558 3.0067 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5003 2.1631 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9639 1.6757 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5148 -2.0197 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8405 2.3779 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.5236 2.0761 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.6037 -0.3985 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.0008 -2.5711 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9429 -0.1059 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2526 -1.6172 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6146 -2.9376 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 35 1 0 0 0 0 2 3 2 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 3 37 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 38 1 0 0 0 0 6 39 1 0 0 0 0 7 8 1 0 0 0 0 7 40 1 0 0 0 0 7 41 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 42 1 0 0 0 0 12 43 1 0 0 0 0 13 14 1 0 0 0 0 13 44 1 0 0 0 0 13 45 1 0 0 0 0 14 15 1 0 0 0 0 14 46 1 0 0 0 0 14 47 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 48 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 33 1 0 0 0 0 22 23 1 0 0 0 0 22 49 1 0 0 0 0 22 50 1 0 0 0 0 23 24 2 0 0 0 0 23 28 1 0 0 0 0 24 25 1 0 0 0 0 24 51 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 29 30 1 0 0 0 0 29 52 1 0 0 0 0 30 31 2 0 0 0 0 30 53 1 0 0 0 0 31 32 1 0 0 0 0 31 54 1 0 0 0 0 32 55 1 0 0 0 0 33 34 1 0 0 0 0 33 56 1 0 0 0 0 33 57 1 0 0 0 0 34 58 1 0 0 0 0 M END