B4EMH2 -OEChem-04042107503D 26 26 0 1 0 0 0 0 0999 V2000 -5.0083 -0.2280 -0.3408 S 0 0 0 0 0 0 0 0 0 0 0 0 2.8323 1.8944 0.2171 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9733 1.5112 0.6787 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7948 0.9132 -1.5597 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1857 -0.4304 0.1856 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4839 0.0238 0.6667 C 0 0 1 0 0 0 0 0 0 0 0 0 2.3224 -1.2447 0.7745 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7287 -2.1548 -0.2978 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2451 -1.8211 -0.2574 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9619 0.3386 0.3007 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0311 0.9670 -0.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2467 -0.3501 -0.0847 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4337 0.5808 0.0793 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3603 0.5437 1.6227 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1757 -1.7035 1.7599 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3940 -1.0781 0.6289 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1462 -1.8981 -1.2786 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9259 -3.2145 -0.1136 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2391 -1.9421 -1.2301 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2785 -2.4352 0.4832 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3697 -1.2345 0.5511 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1698 -0.6744 -1.1287 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3264 1.4608 -0.5643 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5075 0.9376 1.1123 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2020 2.5211 -0.4409 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9496 -1.1796 0.6025 H 0 0 0 0 0 0 0 0 0 0 0 0 1 13 1 0 0 0 0 1 26 1 0 0 0 0 2 11 1 0 0 0 0 2 25 1 0 0 0 0 3 10 2 0 0 0 0 4 11 2 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 6 14 1 0 0 0 0 7 8 1 0 0 0 0 7 15 1 0 0 0 0 7 16 1 0 0 0 0 8 9 1 0 0 0 0 8 17 1 0 0 0 0 8 18 1 0 0 0 0 9 19 1 0 0 0 0 9 20 1 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 21 1 0 0 0 0 12 22 1 0 0 0 0 13 23 1 0 0 0 0 13 24 1 0 0 0 0 M END $$$$