LL37JX -OEChem-05032301503D 48 52 0 0 0 0 0 0 0999 V2000 -2.5853 -2.2126 -1.8755 F 0 0 0 0 0 0 0 0 0 0 0 0 -2.1700 0.4697 2.0297 F 0 0 0 0 0 0 0 0 0 0 0 0 1.6644 1.4348 -0.1241 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1779 -1.5627 0.1189 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6997 -1.5804 0.1301 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1793 -2.8353 0.2347 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5090 -2.7598 0.2250 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.1812 2.2497 -0.1799 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7106 -0.6725 0.0512 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8430 -1.4432 0.1134 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0345 1.3907 -0.1256 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3294 -1.3426 0.1127 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2144 0.6115 -0.0628 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6801 0.7529 -0.0688 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1648 -0.8803 0.0632 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4190 -0.8657 0.0775 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8444 -0.6160 0.0581 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4632 -1.9045 -0.8882 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2523 -0.5423 1.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8372 -1.6660 -0.9058 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6265 -0.3038 1.0784 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1243 2.7814 -0.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4634 1.2390 -0.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6968 0.9297 -0.0689 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3229 0.6895 -0.0517 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7399 -1.6815 0.1508 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3766 3.3947 -0.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5400 2.6275 -0.2363 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5922 -0.1357 0.0238 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1138 -1.4414 0.1336 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2595 3.3661 -0.2511 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6070 2.5090 -0.1986 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0261 -2.5274 -1.6648 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3463 -0.1041 1.8909 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2352 3.4039 -0.2932 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3859 0.6666 -0.0731 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6023 1.4990 -0.1307 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3884 -2.7064 0.2438 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4459 4.4751 -0.3892 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5107 3.1136 -0.2798 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6694 -0.0016 0.0158 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8106 -2.2713 0.2074 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6355 3.4230 0.6479 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6211 3.2968 -1.1389 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7882 4.3232 -0.3233 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0811 2.1808 0.7332 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0886 2.0151 -1.0499 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8227 3.5787 -0.2985 H 0 0 0 0 0 0 0 0 0 0 0 0 1 20 1 0 0 0 0 2 21 1 0 0 0 0 3 14 2 0 0 0 0 4 15 2 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 12 1 0 0 0 0 6 7 2 0 0 0 0 7 10 1 0 0 0 0 8 24 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 9 10 2 0 0 0 0 9 14 1 0 0 0 0 10 15 1 0 0 0 0 11 13 1 0 0 0 0 11 14 1 0 0 0 0 11 22 2 0 0 0 0 12 18 2 0 0 0 0 12 19 1 0 0 0 0 13 15 1 0 0 0 0 13 23 2 0 0 0 0 16 17 1 0 0 0 0 16 20 2 0 0 0 0 16 21 1 0 0 0 0 17 25 2 0 0 0 0 17 26 1 0 0 0 0 18 20 1 0 0 0 0 18 33 1 0 0 0 0 19 21 2 0 0 0 0 19 34 1 0 0 0 0 22 27 1 0 0 0 0 22 35 1 0 0 0 0 23 28 1 0 0 0 0 23 36 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 37 1 0 0 0 0 26 30 2 0 0 0 0 26 38 1 0 0 0 0 27 28 2 0 0 0 0 27 39 1 0 0 0 0 28 40 1 0 0 0 0 29 30 1 0 0 0 0 29 41 1 0 0 0 0 30 42 1 0 0 0 0 31 43 1 0 0 0 0 31 44 1 0 0 0 0 31 45 1 0 0 0 0 32 46 1 0 0 0 0 32 47 1 0 0 0 0 32 48 1 0 0 0 0 M END $$$$