7347 -OEChem-03182422023D 23 22 0 0 0 0 0 0 0999 V2000 0.0001 0.0006 1.1904 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.8134 1.8137 -1.0394 S 0 0 0 0 0 0 0 0 0 0 0 0 0.8133 -1.8140 -1.0387 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.4906 -0.0521 0.1049 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4905 0.0526 0.1044 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2268 0.5696 0.0297 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2268 -0.5693 0.0299 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6316 0.3013 -0.7453 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7787 -1.1295 1.0549 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6309 -0.3016 -0.7462 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7795 1.1288 1.0555 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4180 1.1124 -1.4412 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4627 0.6066 -0.1019 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9215 -0.5831 -1.3214 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7993 -1.5016 0.9221 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6745 -0.7481 2.0749 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0839 -1.9587 0.8956 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4610 -0.6100 -0.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9231 0.5833 -1.3203 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4159 -1.1106 -1.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6765 0.7460 2.0751 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0845 1.9581 0.8982 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 1.5010 0.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 1 6 1 0 0 0 0 1 7 1 0 0 0 0 2 6 2 0 0 0 0 3 7 2 0 0 0 0 4 6 1 0 0 0 0 4 8 1 0 0 0 0 4 9 1 0 0 0 0 5 7 1 0 0 0 0 5 10 1 0 0 0 0 5 11 1 0 0 0 0 8 12 1 0 0 0 0 8 13 1 0 0 0 0 8 14 1 0 0 0 0 9 15 1 0 0 0 0 9 16 1 0 0 0 0 9 17 1 0 0 0 0 10 18 1 0 0 0 0 10 19 1 0 0 0 0 10 20 1 0 0 0 0 11 21 1 0 0 0 0 11 22 1 0 0 0 0 11 23 1 0 0 0 0 M END > 7347 > 0.6 > 1 10 9 21 7 13 20 4 22 2 11 6 8 15 18 19 17 14 12 5 16 3 > 11 1 -0.28 10 0.3 11 0.3 2 -0.38 3 -0.38 4 -0.66 5 -0.66 6 0.58 7 0.58 8 0.3 9 0.3 > 4 > 2 1 2 acceptor 1 3 acceptor > 11 > 0 > 0 > 0 > 0 > 0 > 1 > 1 > 00001CB300000001 > 42.8226 > 10.149 > 10219947 1 18343303694847926441 10857977 72 18259984911440100785 11062470 55 15502376720542171533 12897270 3 18410573959381660361 12932764 1 18411696578155210490 13839132 238 17825386284678521580 14251717 144 17988351654756708405 15775835 57 18201715167581856262 16945 1 18410856576819658939 18175812 5 18410855481602998351 18186145 218 17560806554143390336 18342897 55 18130489912319953845 18380122 1 18410575076073150854 190213 19 15770055021015597098 19422 9 15770060540048572418 20201158 50 18341332206212101099 21061003 4 18131358513515766441 21501502 16 18122344575367381033 23402539 116 18040991843214639934 23532345 42 18114744965881864208 23557571 272 18187093840670803895 5084963 1 18335990791915040488 57812782 119 18409164390191877058 75552 356 17749111097296416791 81228 2 18042975268129577053 > 227.96 5.66 1.64 1.31 0 0 0.09 0 -0.29 0 -0.46 0 0 1.07 > 389.538 > 155.8 > 2 5 10 $$$$