MMs03149955 MOE2007 2D CORINA 3.40 0006 02.08.2006 58 62 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 0.7414 -1.3040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0172 -2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7242 -3.9020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2242 -3.9119 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9656 -5.2159 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4655 -5.2258 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2241 -3.9318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7241 -3.9417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4655 -5.2457 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7069 -6.5397 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2069 -6.5298 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4483 -7.8238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1897 -9.1278 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6897 -9.1377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4311 -10.4417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6725 -11.7357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1725 -11.7258 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4312 -10.4218 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9654 -5.2556 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7068 -6.5595 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7240 -3.9615 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.2240 -3.9715 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9826 -2.6774 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 12.5826 -3.7166 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4753 -2.5305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7969 -1.0654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5029 -0.3068 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3815 -1.3031 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4827 -2.6278 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2413 -1.3337 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9827 -2.6179 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2414 -1.3139 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 -1.2172 -2.5901 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1173 -4.9372 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3309 -2.9064 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5342 -7.0464 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5240 -8.5891 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9931 -8.6201 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6311 -10.4496 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2656 -12.7789 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5657 -12.7611 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2312 -10.4139 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1309 -2.9184 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0078 -5.1518 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3489 -4.3893 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4674 -3.7305 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6679 -2.6638 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9357 -1.4437 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2922 0.0276 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2146 0.6594 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6164 0.5021 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8482 -0.2787 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4483 -7.8437 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.6482 -7.8516 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 2 33 2 0 0 0 0 3 4 2 0 0 0 0 3 37 1 0 0 0 0 4 5 1 0 0 0 0 4 38 1 0 0 0 0 5 6 2 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 9 10 2 0 0 0 0 9 39 1 0 0 0 0 10 11 1 0 0 0 0 10 20 1 0 0 0 0 11 12 1 0 0 0 0 11 57 2 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 17 18 2 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 19 46 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 47 1 0 0 0 0 23 24 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 29 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 30 31 2 0 0 0 0 30 32 1 0 0 0 0 32 33 1 0 0 0 0 33 56 1 0 0 0 0 57 58 1 0 0 0 0 M END