D0M7IA -OEChem-10101305022D 88 94 0 1 0 0 0 0 0999 V2000 7.0724 0.1965 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9065 2.4729 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0213 2.8417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6730 2.5422 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9994 3.0496 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4223 -0.9174 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9346 -0.0970 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.9924 3.2016 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4170 1.5686 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.8869 -0.4023 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.3202 0.6362 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.8290 -3.7011 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7707 1.1856 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.4033 0.9396 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.8185 1.4910 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.5113 1.8576 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.7123 1.8907 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 12.2996 2.8350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0779 0.8190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4092 0.9422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6068 2.4683 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3473 3.1403 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0942 -0.0114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3596 1.3554 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6904 2.0986 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0505 0.4044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4635 1.5523 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3750 1.5877 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9824 0.2083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1028 1.8879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7560 -0.1716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7355 -0.3804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7276 0.1627 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1357 4.1177 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7634 -0.7546 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1940 -0.7691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2041 2.2243 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0936 2.1196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6752 0.5749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7133 0.3710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3942 1.3561 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4544 -1.7056 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1563 1.9189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6274 0.2696 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1463 -1.0744 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4535 -1.4410 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3680 0.9416 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1235 -2.4488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4762 -1.9136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3580 -2.0517 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6653 -2.4183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6173 -2.7237 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3611 0.9963 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0091 1.7505 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6912 1.0269 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9191 2.8590 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3835 3.4493 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0164 2.6576 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5468 0.2796 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7125 -0.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5371 -0.9678 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9255 -0.4249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7416 4.2489 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0044 4.7236 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5297 3.9864 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6064 3.3025 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3698 -0.6257 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9094 2.7116 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2160 0.1583 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2998 -0.0909 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2528 2.9982 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0292 -0.7908 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6154 2.3356 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7587 -0.3364 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8631 -1.2518 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4515 3.6182 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3473 -1.3071 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8698 -2.0425 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6051 -2.5200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6627 -2.8636 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5384 -2.9095 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5842 -2.0339 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9483 -2.2411 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2061 -2.8350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.1098 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4773 -0.5916 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.7794 1.0529 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3699 -4.1177 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 14 1 0 0 0 0 1 26 1 0 0 0 0 2 17 1 0 0 0 0 2 30 1 0 0 0 0 3 17 1 0 0 0 0 3 66 1 0 0 0 0 4 28 1 0 0 0 0 4 71 1 0 0 0 0 5 25 2 0 0 0 0 6 31 1 0 0 0 0 6 72 1 0 0 0 0 7 29 2 0 0 0 0 8 37 1 0 0 0 0 8 76 1 0 0 0 0 9 41 1 0 0 0 0 9 85 1 0 0 0 0 10 45 1 0 0 0 0 10 86 1 0 0 0 0 11 47 1 0 0 0 0 11 87 1 0 0 0 0 12 52 1 0 0 0 0 12 88 1 0 0 0 0 13 15 1 0 0 0 0 13 16 1 0 0 0 0 13 29 1 1 0 0 0 13 53 1 0 0 0 0 14 17 1 0 0 0 0 14 20 1 0 0 0 0 14 23 1 0 0 0 0 15 19 1 0 0 0 0 15 21 1 0 0 0 0 15 54 1 6 0 0 0 16 18 1 0 0 0 0 16 27 1 0 0 0 0 16 55 1 1 0 0 0 17 25 1 0 0 0 0 18 22 1 0 0 0 0 18 56 1 0 0 0 0 18 57 1 0 0 0 0 19 28 1 0 0 0 0 19 31 2 0 0 0 0 20 30 2 0 0 0 0 20 33 1 0 0 0 0 21 22 2 0 0 0 0 21 58 1 0 0 0 0 22 34 1 0 0 0 0 23 35 1 0 0 0 0 23 59 1 0 0 0 0 23 60 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 28 2 0 0 0 0 26 32 2 0 0 0 0 27 37 2 0 0 0 0 27 39 1 0 0 0 0 29 36 1 0 0 0 0 30 38 1 0 0 0 0 31 32 1 0 0 0 0 32 61 1 0 0 0 0 33 40 2 0 0 0 0 33 62 1 0 0 0 0 34 63 1 0 0 0 0 34 64 1 0 0 0 0 34 65 1 0 0 0 0 35 42 2 0 0 0 0 35 67 1 0 0 0 0 36 45 2 0 0 0 0 36 46 1 0 0 0 0 37 43 1 0 0 0 0 38 41 2 0 0 0 0 38 68 1 0 0 0 0 39 44 2 0 0 0 0 39 69 1 0 0 0 0 40 41 1 0 0 0 0 40 70 1 0 0 0 0 42 48 1 0 0 0 0 42 49 1 0 0 0 0 43 47 2 0 0 0 0 43 73 1 0 0 0 0 44 47 1 0 0 0 0 44 74 1 0 0 0 0 45 50 1 0 0 0 0 46 51 2 0 0 0 0 46 75 1 0 0 0 0 48 80 1 0 0 0 0 48 81 1 0 0 0 0 48 82 1 0 0 0 0 49 77 1 0 0 0 0 49 78 1 0 0 0 0 49 79 1 0 0 0 0 50 52 2 0 0 0 0 50 83 1 0 0 0 0 51 52 1 0 0 0 0 51 84 1 0 0 0 0 M END $$$$