MMs03543466 MOE2007 2D CORINA 3.40 0006 02.08.2006 53 55 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 1.3054 -0.7389 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3182 -2.2388 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0222 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 1.8369 1.3148 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3590 -1.2704 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8906 0.7832 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8778 2.2832 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1704 3.0442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4758 2.3053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4886 0.8054 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 0.0443 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7939 0.0665 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8067 -1.4335 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0865 0.8275 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3919 0.0886 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.3919 1.2886 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4047 -1.4113 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7101 -2.1502 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7229 -3.6501 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 13.0283 -4.3890 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6845 0.8497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0600 0.2513 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.3195 -0.9203 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0541 1.3745 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5541 1.3873 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2930 2.6927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5319 3.9853 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0320 3.9725 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2931 2.6671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8286 2.3428 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5911 1.0443 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0443 0.5911 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5911 -1.0443 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1182 -2.2491 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3284 -3.4388 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5181 -2.2286 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8335 2.8743 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1601 4.2442 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5098 2.9142 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2062 -1.1556 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0763 2.0275 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2212 -1.2130 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0039 -2.5424 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1109 -1.0191 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8936 -2.3485 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4372 -5.4334 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0726 -4.9802 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6194 -3.3447 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1629 0.3532 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.4929 2.7029 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1230 5.0296 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4231 5.0066 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 4 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 4 5 2 0 0 0 0 4 6 2 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 9 39 1 0 0 0 0 10 11 2 0 0 0 0 10 40 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 12 41 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 42 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 22 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 20 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 21 47 1 0 0 0 0 21 48 1 0 0 0 0 21 49 1 0 0 0 0 22 23 1 0 0 0 0 22 31 2 0 0 0 0 23 24 1 0 0 0 0 23 25 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 50 1 0 0 0 0 27 28 1 0 0 0 0 27 51 1 0 0 0 0 28 29 2 0 0 0 0 28 52 1 0 0 0 0 29 30 1 0 0 0 0 29 53 1 0 0 0 0 30 31 1 0 0 0 0 M END