HMDB0061495 RDKit 3D PE(DiMe(13,5)/MonoMe(11,5)) 150151 0 0 0 0 0 0 0 0999 V2000 -15.3449 3.7424 0.2227 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.2315 2.8311 0.9909 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.4072 1.4622 0.4314 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.2394 0.5694 0.3375 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.0996 1.0183 -0.5029 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.0524 -0.0628 -0.4966 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.1075 -1.2627 0.1443 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9180 -1.9073 -0.1454 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.5244 -3.2491 0.3433 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2194 -1.0576 -0.9424 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8264 -1.3559 -1.5131 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3577 -0.1624 -2.2359 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0702 -0.1403 -2.9275 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7822 -0.2977 -2.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4701 -1.5785 -1.5941 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0905 -1.5298 -0.9513 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9729 -1.2358 -1.9337 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8443 -2.2435 -3.0083 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7586 -2.0071 -3.9912 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3739 -1.9797 -3.4348 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0630 -0.8643 -2.5366 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5351 0.2738 -2.7416 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2421 -1.0628 -1.4426 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0574 -0.0596 -0.5573 C 0 0 2 0 0 0 0 0 0 0 0 0 1.5297 0.3848 -0.5231 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6452 1.4035 0.4356 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8341 2.0249 0.7833 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8612 1.6340 0.1903 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7476 3.0751 1.8065 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0809 2.7442 3.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3590 1.5926 3.8145 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8226 0.2365 3.3499 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2186 -0.0237 3.9115 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8213 -1.3047 3.5085 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1355 -1.4514 2.0295 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1169 -0.3489 1.6802 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6071 -0.3402 0.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3894 -1.5944 -0.0709 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5498 -1.7977 0.8275 C 0 0 0 0 0 0 0 0 0 0 0 0 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