MMs02950128 MOE2007 2D CORINA 3.40 0006 02.08.2006 52 55 0 0 0 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 -1.1256 -0.9915 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5471 -0.5124 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8429 0.9582 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7173 1.9496 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2958 1.4705 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2643 1.4372 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.3899 0.4458 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.3985 -0.6798 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3814 1.5714 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5155 -0.5457 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9370 -0.0666 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0626 -1.0580 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7668 -2.5286 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3453 -3.0077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2197 -2.0162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7983 -2.4953 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -10.4840 -0.5790 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.7798 0.8916 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.6096 -1.5704 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -13.0311 -1.0913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.3269 0.3792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.7483 0.8583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.8739 -0.1332 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.5781 -1.6037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.1567 -2.0828 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.2954 0.3459 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -16.8163 1.7673 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -17.7745 -1.0755 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -18.7168 0.8250 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -19.8424 -0.1665 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -19.7019 -1.6599 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -21.0789 -2.2550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -22.0703 -1.1294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -21.3062 0.1614 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 1.1371 -0.3833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8890 -2.1679 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4475 -1.3055 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9539 3.1261 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6047 2.2637 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5010 2.6137 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1736 1.1098 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6673 -3.3218 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1087 -4.1841 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3730 -2.7469 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.4264 1.1724 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.9850 2.0347 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.4786 -2.3969 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.9200 -3.2592 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -18.9535 2.0014 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -21.3412 -3.4260 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -23.2650 -1.2418 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 36 1 0 0 0 0 2 3 2 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 3 38 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 39 1 0 0 0 0 6 40 1 0 0 0 0 7 8 1 0 0 0 0 7 41 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 42 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 14 15 2 0 0 0 0 14 43 1 0 0 0 0 15 16 1 0 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 26 49 1 0 0 0 0 27 28 2 0 0 0 0 27 29 2 0 0 0 0 27 30 1 0 0 0 0 30 31 1 0 0 0 0 30 50 1 0 0 0 0 31 32 2 0 0 0 0 31 35 1 0 0 0 0 32 33 1 0 0 0 0 33 34 2 0 0 0 0 33 51 1 0 0 0 0 34 35 1 0 0 0 0 34 52 1 0 0 0 0 M END