B0T1AI -OEChem-04012113563D 20 21 0 0 0 0 0 0 0999 V2000 -4.0520 0.9605 0.2560 S 0 0 0 0 0 0 0 0 0 0 0 0 4.0449 0.9665 -0.2517 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.5975 -1.8235 1.3593 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6236 -1.8232 -1.3515 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7473 -0.1651 0.1071 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7608 -0.1530 -0.1034 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6313 -1.0196 0.4151 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6338 -1.0299 -0.4144 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8097 0.7529 -0.9807 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7922 0.7671 0.9670 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9006 -0.1536 0.8605 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9037 -0.1608 -0.8510 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0082 1.4310 -1.0173 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9876 1.4506 1.0052 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0238 0.9178 -1.7069 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9983 0.9378 1.6828 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1325 -0.7414 1.7381 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1430 -0.7614 -1.7178 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3208 2.1802 -1.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2906 2.2110 1.7111 H 0 0 0 0 0 0 0 0 0 0 0 0 1 11 1 0 0 0 0 1 13 1 0 0 0 0 2 12 1 0 0 0 0 2 14 1 0 0 0 0 3 7 2 0 0 0 0 4 8 2 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 5 11 2 0 0 0 0 6 8 1 0 0 0 0 6 10 1 0 0 0 0 6 12 2 0 0 0 0 7 8 1 0 0 0 0 9 13 2 0 0 0 0 9 15 1 0 0 0 0 10 14 2 0 0 0 0 10 16 1 0 0 0 0 11 17 1 0 0 0 0 12 18 1 0 0 0 0 13 19 1 0 0 0 0 14 20 1 0 0 0 0 M END $$$$