MMs03179822 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 46 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 1.5000 -0.0056 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2451 -1.3075 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4903 -2.6037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0097 -2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7549 -1.2962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7646 -3.8943 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.6131 -3.0457 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2330 -4.2006 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3954 -5.6918 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0273 -6.3071 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0195 -5.1961 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4805 -5.2017 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.6805 -5.2017 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2354 -3.9055 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2256 -6.5036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4708 -7.7998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2159 -9.1016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7159 -9.1073 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4708 -7.8110 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7256 -6.5092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6972 -6.4370 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9934 -5.6821 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2953 -6.4272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3009 -7.9272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0047 -8.6821 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7028 -7.9369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6027 -8.6723 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.5961 1.0415 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1039 1.0314 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4451 -1.3120 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9549 -1.2917 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3539 -3.0068 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4330 -4.1961 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2708 -7.7953 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6120 -10.1386 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6707 -7.8155 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3295 -5.4722 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9889 -4.4821 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3322 -5.8233 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0092 -9.8821 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6659 -8.5408 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 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 4 5 2 0 0 0 0 4 15 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 12 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 9 34 1 0 0 0 0 10 11 2 0 0 0 0 10 22 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 35 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 39 1 0 0 0 0 24 25 1 0 0 0 0 24 40 1 0 0 0 0 25 26 2 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 26 41 1 0 0 0 0 27 42 1 0 0 0 0 M END