MMs03081378 MOE2007 2D CORINA 3.40 0006 02.08.2006 54 56 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 -0.7518 -1.2980 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0036 -2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4964 -2.6002 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3798 -1.3879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8057 -1.8534 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8036 -3.3534 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3764 -3.8149 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0625 -5.2817 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1758 -6.2869 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6030 -5.8254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9169 -4.3586 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.7164 -6.8306 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6353 -5.7432 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2518 -1.2959 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0000 0.0042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5000 0.0062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2518 -1.2918 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5036 -2.5918 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0036 -2.5939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7518 -1.2897 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5036 -2.5877 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.5000 0.0104 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.0000 0.0125 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -8.4000 1.0517 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7518 -1.2855 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2518 -1.2834 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0036 -2.5814 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2554 -3.8815 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.7482 1.3126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2482 1.3146 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0384 -0.6014 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6014 1.0384 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0384 0.6014 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1318 -3.0069 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2031 -3.7801 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0105 -0.2461 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4652 -8.0041 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8581 -6.4614 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2554 -4.9390 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3841 -6.9167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3986 1.0426 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0986 1.0463 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1050 -3.6302 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4050 -3.6340 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8986 1.0488 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6247 -1.6975 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9618 -2.4670 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0418 -0.1020 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.3789 -0.8714 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.5036 -2.5794 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.9964 2.6106 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.5949 3.6506 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.1050 -3.6177 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 15 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 2 0 0 0 0 4 8 1 0 0 0 0 5 6 1 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 20 45 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 30 1 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 27 28 1 0 0 0 0 27 49 1 0 0 0 0 27 50 1 0 0 0 0 28 29 2 0 0 0 0 28 51 1 0 0 0 0 30 31 2 0 0 0 0 30 52 1 0 0 0 0 51 54 1 0 0 0 0 52 53 1 0 0 0 0 M END