corina 12080917083D 1 1.00000 0.00000 CORINA 3.46 0026 05.08.2008 20 20 0 0 0 0 0 0 0 0999 V2000 -0.0370 1.3409 -0.0016 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1273 2.0837 -0.0578 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3543 1.4465 -0.0618 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4166 0.0668 -0.0091 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2520 -0.6762 0.0475 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0254 -0.0393 0.0506 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3742 2.0357 0.0091 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7170 2.5038 -1.4066 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.8976 1.3052 -2.3021 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9933 3.3045 -1.3756 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2671 4.3277 -2.4477 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7001 0.6678 -2.9584 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0019 0.8556 -2.4937 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7966 3.1263 -0.4918 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7302 -0.6154 -0.0139 N 0 3 0 0 0 0 0 0 0 0 0 0 4.7562 0.0391 -0.0642 O 0 5 0 0 0 0 0 0 0 0 0 0 3.7852 -1.8313 0.0325 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0605 3.5613 -0.1141 N 0 3 0 0 0 0 0 0 0 0 0 0 2.0788 4.2115 -0.2680 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.0128 4.1269 -0.0066 O 0 0 0 0 0 0 0 0 0 0 0 0 8 10 1 0 0 0 0 2 3 1 0 0 0 0 10 11 1 0 0 0 0 5 6 2 0 0 0 0 9 12 1 0 0 0 0 6 1 1 0 0 0 0 9 13 2 0 0 0 0 1 2 2 0 0 0 0 10 14 2 0 0 0 0 4 15 1 0 0 0 0 2 18 1 0 0 0 0 1 7 1 0 0 0 0 3 4 2 0 0 0 0 7 8 1 0 0 0 0 15 16 1 0 0 0 0 15 17 2 0 0 0 0 8 9 1 0 0 0 0 4 5 1 0 0 0 0 18 19 1 0 0 0 0 18 20 2 0 0 0 0 G 15 4 NO2 G 18 2 NO2 M CHG 4 15 1 16 -1 18 1 19 -1 M STY 2 1 SUP 2 SUP M SLB 2 1 1 2 2 M SAL 1 3 15 16 17 M SBL 1 1 10 M SMT 1 NO2 M SBV 1 10 -0.5600 0.3300 M SAL 2 3 18 19 20 M SBL 2 1 11 M SMT 2 NO2 M SBV 2 11 0.5600 0.3200 M END $$$$