MMs01957641 MOE2007 2D CORINA 3.40 0006 02.08.2006 59 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 0.7417 -1.3038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0166 -2.5980 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2416 -1.3134 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9999 -0.0192 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.5999 -1.0585 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2583 1.2846 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6583 2.3238 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0166 2.5788 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.6166 3.6180 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5166 2.5692 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.7166 2.5692 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2582 1.2654 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 -0.0288 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.6999 -0.0288 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2416 -1.3327 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7415 -1.3423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4832 -2.6461 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9832 -2.6557 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7415 -1.3615 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9998 -0.0577 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4998 -0.0481 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2414 -1.3711 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.9998 -0.0769 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4997 -0.0865 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2414 -1.3903 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.4831 -2.6845 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9831 -2.6749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7414 -1.3999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4830 -2.7038 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.4997 -0.1057 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2749 3.8634 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5332 5.1672 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2749 3.8826 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7583 1.2942 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0431 0.5933 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5933 1.0431 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0431 -0.5933 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8350 -2.3565 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8766 -3.6814 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5765 -3.6987 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6065 0.9777 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9065 0.9950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8748 0.3407 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2157 1.1035 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2989 1.0966 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6300 0.3167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6081 -3.1022 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2671 -3.8649 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8529 -3.0781 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1839 -3.8580 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.5350 -0.7124 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.1063 0.9296 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4643 0.5009 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1892 3.0862 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1990 4.6288 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1399 6.2026 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0750 3.8903 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1650 2.3373 0.0000 H 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 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 14 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 35 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 34 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 32 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 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 40 1 0 0 0 0 19 20 1 0 0 0 0 19 41 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 42 1 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 23 28 1 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 26 27 1 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 27 49 1 0 0 0 0 28 50 1 0 0 0 0 28 51 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 31 52 1 0 0 0 0 31 53 1 0 0 0 0 31 54 1 0 0 0 0 32 33 1 0 0 0 0 32 55 1 0 0 0 0 32 56 1 0 0 0 0 33 57 1 0 0 0 0 34 58 1 0 0 0 0 35 59 1 0 0 0 0 M END