MMs01064839 MOE2007 2D CORINA 3.40 0006 02.08.2006 59 63 0 0 1 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 -0.7609 -1.2927 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0218 -2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4782 -2.6106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2390 -1.3179 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4999 -0.0126 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7390 -1.3304 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4998 -0.0377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9998 -0.0503 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7389 -1.3556 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9780 -2.6483 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4781 -2.6357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2388 -1.3682 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9779 -2.6734 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9997 -0.0755 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.4996 -0.0880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2605 1.2047 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.8605 0.1654 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6619 2.5801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7850 3.5744 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0777 2.8135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7535 1.3489 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9297 -4.0410 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7088 -4.9125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4973 -4.0206 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9460 -4.4094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5461 -5.7841 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8466 -7.1120 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3726 -7.3900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7643 -6.4114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5913 1.0442 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3757 0.3821 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7181 1.1423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8013 1.1332 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1308 0.3506 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3389 -2.3948 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1022 -3.0682 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7597 -3.8283 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3470 -3.0367 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6765 -3.8192 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4084 0.9688 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2814 -1.2680 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6238 -0.5079 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6177 1.9888 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9647 3.5568 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9000 4.3848 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4985 4.5392 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5750 3.9056 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2158 2.4331 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9911 -3.2102 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1251 -4.1863 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5112 -5.0710 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4564 -6.5660 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0059 -7.4217 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8018 -8.3111 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8520 -8.4900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5932 -8.1023 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9235 -6.1011 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3250 -7.4724 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 31 1 0 0 0 0 2 3 2 0 0 0 0 3 4 1 0 0 0 0 3 25 1 0 0 0 0 4 5 2 0 0 0 0 4 23 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 12 39 1 0 0 0 0 12 40 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 41 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 22 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 20 47 1 0 0 0 0 21 22 1 0 0 0 0 21 48 1 0 0 0 0 21 49 1 0 0 0 0 23 24 2 0 0 0 0 24 25 1 0 0 0 0 24 30 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 27 28 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 28 29 1 0 0 0 0 28 54 1 0 0 0 0 28 55 1 0 0 0 0 29 30 1 0 0 0 0 29 56 1 0 0 0 0 29 57 1 0 0 0 0 30 58 1 0 0 0 0 30 59 1 0 0 0 0 M END