LJMF17 -OEChem-05032301353D 27 28 0 0 0 0 0 0 0999 V2000 0.7140 2.6514 -0.5187 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.9936 0.6858 2.1215 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5223 0.1782 -0.1292 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8057 -1.6844 0.5054 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6997 -0.6981 -0.2289 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4046 -1.2588 0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9145 0.6066 -0.1395 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4739 1.0074 -0.2932 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8577 0.3574 -0.2505 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5248 0.2290 0.9526 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3958 -0.1063 -1.4365 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7767 -0.3862 0.9714 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6479 -0.7210 -1.4182 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3382 -0.8611 -0.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0220 -2.7269 0.2569 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9230 -1.5566 1.5884 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6989 -0.6175 0.2076 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8051 -1.0023 -1.2774 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1277 -1.7224 -0.8754 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6624 -1.5142 0.8383 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1243 1.1261 0.8026 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1461 1.2621 -0.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8647 -0.0039 -2.3785 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3197 -0.4987 1.9058 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0848 -1.0913 -2.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3129 -1.3401 -0.1995 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1194 1.0780 1.9642 H 0 0 0 0 0 0 0 0 0 0 0 0 1 8 2 0 0 0 0 2 10 1 0 0 0 0 2 27 1 0 0 0 0 3 6 1 0 0 0 0 3 7 1 0 0 0 0 3 8 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 15 1 0 0 0 0 4 16 1 0 0 0 0 5 7 1 0 0 0 0 5 17 1 0 0 0 0 5 18 1 0 0 0 0 6 19 1 0 0 0 0 6 20 1 0 0 0 0 7 21 1 0 0 0 0 7 22 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 2 0 0 0 0 10 12 2 0 0 0 0 11 13 1 0 0 0 0 11 23 1 0 0 0 0 12 14 1 0 0 0 0 12 24 1 0 0 0 0 13 14 2 0 0 0 0 13 25 1 0 0 0 0 14 26 1 0 0 0 0 M END $$$$