MMs02602957 MOE2007 2D CORINA 3.40 0006 02.08.2006 40 41 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 1.2949 0.7571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8930 0.7712 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3610 -1.4627 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8299 -1.7665 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.5728 -0.4634 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5631 0.6458 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8669 2.1147 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0637 -0.2985 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.9520 -1.5073 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4429 -1.3424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0455 0.0313 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.3311 -2.5511 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.8220 -2.3862 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4247 -1.0126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9156 -0.8477 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8039 -2.0564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2012 -3.4300 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7103 -3.5949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1077 -4.9685 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.6056 1.0360 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0360 -0.6056 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6056 -1.0360 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5186 1.6721 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0613 1.6805 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8317 -0.9093 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3744 -0.9009 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1166 1.6862 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6593 1.6946 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0062 2.4917 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9708 2.9128 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8763 -2.0392 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2890 -2.6590 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8490 -3.6500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7141 -0.0456 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3977 0.2512 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.9966 -1.9244 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.9118 -4.3970 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 36 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 37 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 19 20 2 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 M END