MMs01145679 MOE2007 2D CORINA 3.40 0006 02.08.2006 58 61 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 0.6161 -1.3677 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1085 -1.5180 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7246 -2.8856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8482 -4.1030 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2170 -3.0359 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0934 -1.8186 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5859 -1.9689 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2019 -3.3365 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3255 -4.5539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8331 -4.4036 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.1437 -5.5627 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9567 -5.6209 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6944 -3.4868 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3104 -4.8545 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5708 -2.2695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1010 -0.8449 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3107 0.0420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7680 1.4706 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2680 1.4771 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7377 0.0526 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 11.5281 -0.8344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0707 -2.2630 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.9577 -3.4726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4488 -3.3094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0529 -1.9364 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5440 -1.7731 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4310 -2.9828 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8268 -4.3558 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3357 -4.5191 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7316 -5.8920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0941 0.4928 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4928 1.0941 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0941 -0.4928 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5470 -1.6630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7050 -2.5644 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8096 -0.5441 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0126 -1.2972 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4192 -0.6636 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4969 -0.7722 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7489 -1.6735 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4064 -5.0752 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9998 -5.7088 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9828 -4.9198 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2556 -6.5948 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9306 -6.3220 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9582 -0.4791 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0585 2.4383 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9691 2.4510 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8814 -4.0034 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2935 -4.6247 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3434 -0.9687 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.0273 -0.6748 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.6238 -2.8522 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.5364 -5.3235 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6332 -5.4087 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2483 -6.9904 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8299 -6.3753 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 3 37 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 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 7 39 1 0 0 0 0 8 9 1 0 0 0 0 8 40 1 0 0 0 0 8 41 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 10 42 1 0 0 0 0 10 43 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 44 1 0 0 0 0 13 45 1 0 0 0 0 13 46 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 16 23 1 0 0 0 0 17 18 1 0 0 0 0 17 47 1 0 0 0 0 18 19 1 0 0 0 0 18 22 2 0 0 0 0 19 20 2 0 0 0 0 19 48 1 0 0 0 0 20 21 1 0 0 0 0 20 49 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 50 1 0 0 0 0 24 51 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 52 1 0 0 0 0 27 28 1 0 0 0 0 27 53 1 0 0 0 0 28 29 2 0 0 0 0 28 54 1 0 0 0 0 29 30 1 0 0 0 0 29 55 1 0 0 0 0 30 31 1 0 0 0 0 31 56 1 0 0 0 0 31 57 1 0 0 0 0 31 58 1 0 0 0 0 M END