MMs01799868 MOE2007 2D CORINA 3.40 0006 02.08.2006 58 62 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 -0.7413 -1.3040 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2413 -1.3140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9999 -0.0200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4999 -0.0300 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2412 -1.3340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4826 -2.6280 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9826 -2.6180 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2240 -3.9120 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9653 -5.2160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7412 -1.3439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4825 -2.6479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9825 -2.6579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7411 -1.3639 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.9998 -0.0599 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7584 1.2341 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.4998 -0.0499 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.7585 1.2541 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2585 1.2641 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7238 -3.9619 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.2238 -3.9719 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9824 -2.6779 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.4824 -2.6879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.2237 -3.9919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.4651 -5.2859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9651 -5.2759 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.2064 -6.5899 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -15.7237 -4.0019 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -16.4823 -2.7079 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.9823 -2.7178 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -18.7236 -4.0218 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -17.9650 -5.3159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.4650 -5.3059 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0432 -0.5931 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5931 1.0432 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0432 0.5931 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4069 1.0232 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0757 -3.6712 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0085 -4.6229 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5584 -6.2592 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9221 -5.8091 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8756 -3.6832 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8888 1.6570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5580 2.4372 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1337 1.6820 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4748 2.4444 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1169 -4.9971 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3894 -1.6347 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.0893 -1.6527 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3582 -6.3111 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.3575 -2.2899 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.6986 -1.5275 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.7818 -1.5347 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -19.1126 -2.3149 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -19.0899 -5.7338 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.7488 -6.4962 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.3347 -5.7088 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.6655 -6.4890 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 19 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 39 1 0 0 0 0 10 40 1 0 0 0 0 10 41 1 0 0 0 0 11 12 2 0 0 0 0 11 17 1 0 0 0 0 12 13 1 0 0 0 0 12 42 1 0 0 0 0 13 14 2 0 0 0 0 13 20 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 18 44 1 0 0 0 0 19 45 1 0 0 0 0 19 46 1 0 0 0 0 20 21 1 0 0 0 0 20 47 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 48 1 0 0 0 0 23 24 1 0 0 0 0 23 49 1 0 0 0 0 24 25 2 0 0 0 0 24 28 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 26 50 1 0 0 0 0 28 29 1 0 0 0 0 28 33 1 0 0 0 0 29 30 1 0 0 0 0 29 51 1 0 0 0 0 29 52 1 0 0 0 0 30 31 1 0 0 0 0 30 53 1 0 0 0 0 30 54 1 0 0 0 0 31 32 1 0 0 0 0 32 33 1 0 0 0 0 32 55 1 0 0 0 0 32 56 1 0 0 0 0 33 57 1 0 0 0 0 33 58 1 0 0 0 0 M END