MMs01229127 MOE2007 2D CORINA 3.40 0006 02.08.2006 27 28 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 -1.5000 0.0078 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2432 1.3107 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4864 2.6059 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0135 2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7568 1.2951 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7703 3.8932 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -3.7432 1.3186 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4999 0.0234 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7567 -1.2795 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9999 0.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7567 -1.2639 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -8.2567 -1.2560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1320 -0.0379 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.5610 -0.4940 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.5688 -1.9940 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1446 -2.4650 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -11.7869 -2.8694 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5946 -1.0423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1054 -1.0283 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0810 3.6482 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9567 1.2889 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3378 2.3609 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7854 1.2119 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1254 0.4475 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.8806 -2.3756 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6677 -4.0634 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 19 1 0 0 0 0 2 3 2 0 0 0 0 2 20 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 4 5 2 0 0 0 0 4 21 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 22 1 0 0 0 0 8 9 1 0 0 0 0 8 23 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 24 1 0 0 0 0 11 25 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 26 1 0 0 0 0 18 27 1 0 0 0 0 M END