LGA0R2 -OEChem-05032300093D 49 51 0 1 0 0 0 0 0999 V2000 3.5973 3.3219 -0.4041 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.5249 -0.2767 1.4346 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0730 0.7135 -0.0931 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6670 0.0117 0.1147 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0807 -1.2767 -0.7775 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1099 0.3752 0.7415 C 0 0 2 0 0 0 0 0 0 0 0 0 0.1533 1.3894 -1.3923 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2460 1.3395 0.5403 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0210 2.6449 -1.2595 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1918 2.3657 -0.3819 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6417 -1.0239 0.4759 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3315 0.2866 0.3536 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4794 1.3782 1.2692 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5033 0.5444 -0.5595 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3072 2.3958 0.8473 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8776 0.2136 -0.6765 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1171 -0.3924 0.0023 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6519 -1.9532 1.5035 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5522 -2.5224 -1.0087 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1443 -3.2238 1.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3813 0.2246 1.3782 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3440 -0.2071 -0.8934 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6050 -3.5220 -0.0507 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0383 -2.8070 -2.3907 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7956 0.4504 1.7912 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7822 1.6585 -1.8855 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6492 0.6579 -2.0416 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4275 3.4483 -0.8055 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3331 2.9817 -2.2543 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7485 0.6892 2.0597 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6097 1.6242 -0.7053 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3351 0.0400 -1.5168 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2916 2.6422 1.2194 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0395 1.2875 -0.8342 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7538 -0.2488 -1.6641 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9579 -1.4705 0.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5428 -0.9863 0.2857 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2908 -1.7142 2.4979 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5153 1.3094 1.3071 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2877 -0.1987 1.8246 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5552 0.0285 2.0692 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5603 0.8540 -1.0582 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2290 -0.6670 -0.4409 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1872 -0.6772 -1.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1690 -3.9802 2.0056 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9914 -4.5096 -0.2785 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0963 -3.0871 -2.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9334 -1.9264 -3.0331 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4597 -3.6216 -2.8376 H 0 0 0 0 0 0 0 0 0 0 0 0 1 10 1 0 0 0 0 1 15 1 0 0 0 0 2 12 2 0 0 0 0 3 6 1 0 0 0 0 3 7 1 0 0 0 0 3 12 1 0 0 0 0 4 14 1 0 0 0 0 4 16 1 0 0 0 0 4 37 1 0 0 0 0 5 11 1 0 0 0 0 5 19 2 0 0 0 0 6 8 1 0 0 0 0 6 11 1 0 0 0 0 6 25 1 0 0 0 0 7 9 1 0 0 0 0 7 26 1 0 0 0 0 7 27 1 0 0 0 0 8 10 2 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 28 1 0 0 0 0 9 29 1 0 0 0 0 11 18 2 0 0 0 0 12 14 1 0 0 0 0 13 15 2 0 0 0 0 13 30 1 0 0 0 0 14 31 1 0 0 0 0 14 32 1 0 0 0 0 15 33 1 0 0 0 0 16 17 1 0 0 0 0 16 34 1 0 0 0 0 16 35 1 0 0 0 0 17 21 1 0 0 0 0 17 22 1 0 0 0 0 17 36 1 0 0 0 0 18 20 1 0 0 0 0 18 38 1 0 0 0 0 19 23 1 0 0 0 0 19 24 1 0 0 0 0 20 23 2 0 0 0 0 20 45 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 23 46 1 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 24 49 1 0 0 0 0 M END $$$$