LE4Y9D -OEChem-05022321402D 68 72 0 0 0 0 0 0 0999 V2000 17.8598 -4.3298 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 3.2043 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 4.7043 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 -1.7957 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 4.7043 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.7553 -5.3243 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.9643 -3.3353 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 -0.2957 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.3923 -1.7957 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.8817 -3.9117 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.4968 -2.7902 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.9750 -2.1321 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 18.8543 -4.4343 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.5138 -0.4108 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 1.7043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 1.2043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 2.7043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 3.2043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 2.7043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 1.2043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 0.2043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 1.7043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 0.2043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 1.7043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -0.2957 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 1.2043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 2.7043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8762 -4.0162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8653 -4.2253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 3.2043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 -1.2957 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4640 -3.2072 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2830 -4.9298 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4585 -3.3117 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2775 -5.0343 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4750 -2.9981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 4.2043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3059 -1.3890 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.7043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 4.2043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 3.2043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 4.7043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 4.2043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 3.0143 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 0.5843 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3913 -0.1057 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 2.3243 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7932 1.3943 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -0.9157 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1972 1.5143 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1996 2.2294 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9966 2.2294 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0632 0.0143 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2118 -2.6408 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9185 -5.4313 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5173 -4.4133 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8230 -2.8101 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.5297 -5.6007 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.0843 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 4.5143 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 2.8943 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 5.3243 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 4.5143 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.1065 -5.0007 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.2188 -3.9327 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1034 -0.2192 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0530 0.0041 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 5.3243 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 6 2 0 0 0 0 1 7 2 0 0 0 0 1 13 1 0 0 0 0 1 29 1 0 0 0 0 2 19 1 0 0 0 0 2 27 1 0 0 0 0 3 37 1 0 0 0 0 3 68 1 0 0 0 0 4 31 2 0 0 0 0 5 37 2 0 0 0 0 8 23 1 0 0 0 0 8 31 1 0 0 0 0 8 53 1 0 0 0 0 9 11 1 0 0 0 0 9 31 1 0 0 0 0 9 38 1 0 0 0 0 10 28 1 0 0 0 0 10 36 1 0 0 0 0 10 56 1 0 0 0 0 11 36 2 0 0 0 0 12 36 1 0 0 0 0 12 38 2 0 0 0 0 13 64 1 0 0 0 0 13 65 1 0 0 0 0 14 38 1 0 0 0 0 14 66 1 0 0 0 0 14 67 1 0 0 0 0 15 16 1 0 0 0 0 15 17 2 0 0 0 0 15 20 1 0 0 0 0 16 21 2 0 0 0 0 16 22 1 0 0 0 0 17 18 1 0 0 0 0 17 44 1 0 0 0 0 18 19 2 0 0 0 0 18 37 1 0 0 0 0 19 24 1 0 0 0 0 20 24 2 0 0 0 0 20 45 1 0 0 0 0 21 25 1 0 0 0 0 21 46 1 0 0 0 0 22 26 2 0 0 0 0 22 47 1 0 0 0 0 23 25 2 0 0 0 0 23 26 1 0 0 0 0 24 48 1 0 0 0 0 25 49 1 0 0 0 0 26 50 1 0 0 0 0 27 30 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 28 32 2 0 0 0 0 28 33 1 0 0 0 0 29 34 2 0 0 0 0 29 35 1 0 0 0 0 30 39 2 0 0 0 0 30 40 1 0 0 0 0 32 34 1 0 0 0 0 32 54 1 0 0 0 0 33 35 2 0 0 0 0 33 55 1 0 0 0 0 34 57 1 0 0 0 0 35 58 1 0 0 0 0 39 41 1 0 0 0 0 39 59 1 0 0 0 0 40 42 2 0 0 0 0 40 60 1 0 0 0 0 41 43 2 0 0 0 0 41 61 1 0 0 0 0 42 43 1 0 0 0 0 42 62 1 0 0 0 0 43 63 1 0 0 0 0 M END $$$$