MMs01682004 MOE2007 2D CORINA 3.40 0006 02.08.2006 38 40 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 -1.2962 -0.7549 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5981 -0.0098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6037 1.4902 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3075 2.2451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0057 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9056 2.2352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2018 1.4803 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.5744 2.0852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8918 3.5513 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.5739 0.9667 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -8.1739 2.0060 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8190 -0.3295 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.3529 -0.0120 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2344 -1.0115 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.0662 1.1179 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.9433 -0.0990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3280 -1.4670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2051 -2.6838 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6975 -2.5327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.3128 -1.1647 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.4357 0.0522 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0510 1.4202 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.5433 1.5713 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0415 -0.5961 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2916 -1.9549 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6350 -0.6138 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3121 3.4451 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0313 2.1039 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1377 3.1574 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6804 3.1516 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5585 2.2123 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1341 -1.5879 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7129 -3.7782 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.3991 -3.5062 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.5067 -1.0438 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1739 2.6370 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.6661 3.7314 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 25 1 0 0 0 0 2 3 2 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 27 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 28 1 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 14 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 13 1 0 0 0 0 11 16 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 16 17 1 0 0 0 0 16 32 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 33 1 0 0 0 0 19 20 1 0 0 0 0 19 34 1 0 0 0 0 20 21 2 0 0 0 0 20 35 1 0 0 0 0 21 22 1 0 0 0 0 21 36 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 23 37 1 0 0 0 0 37 38 1 0 0 0 0 M END