2526 -OEChem-09032120293D 19 18 0 0 0 0 0 0 0999 V2000 1.6677 0.0554 -0.0293 P 0 0 0 0 0 0 0 0 0 0 0 0 0.2496 -0.6257 -0.3860 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9643 -2.2175 0.1167 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2211 1.9869 0.2505 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7550 -0.9563 -0.6689 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7970 -0.2156 1.5597 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8080 1.4920 -0.4407 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9330 -0.0525 0.1763 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1256 -0.8677 -0.3062 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0333 1.4010 -0.2721 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8725 -0.1237 1.2685 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1944 -0.8708 -1.3992 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0677 -0.4949 0.1057 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0257 1.4940 -1.3631 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2336 2.0111 0.1403 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1221 -2.5386 -0.2485 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2509 2.9055 -0.0675 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7060 -0.7193 -0.6268 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5437 0.1885 2.0507 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 1 0 0 0 0 1 6 1 0 0 0 0 1 7 2 0 0 0 0 2 8 1 0 0 0 0 3 9 1 0 0 0 0 3 16 1 0 0 0 0 4 10 1 0 0 0 0 4 17 1 0 0 0 0 5 18 1 0 0 0 0 6 19 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 11 1 0 0 0 0 9 12 1 0 0 0 0 9 13 1 0 0 0 0 10 14 1 0 0 0 0 10 15 1 0 0 0 0 M END > 2526 > 0.6 > 1 6 10 12 8 3 13 5 9 7 11 4 2 > 14 1 1.51 10 0.28 16 0.4 17 0.4 18 0.5 19 0.5 2 -0.55 3 -0.68 4 -0.68 5 -0.77 6 -0.77 7 -0.7 8 0.28 9 0.28 > 4 > 8 1 3 acceptor 1 3 donor 1 4 acceptor 1 4 donor 1 5 acceptor 1 6 acceptor 1 7 acceptor 4 1 5 6 7 anion > 10 > 0 > 0 > 0 > 0 > 0 > 1 > 1 > 000009DE00000001 > -12.9274 > 40.634 > 10857977 72 18054780947519485971 12716758 59 18270394980057513723 12897270 3 18266745868558223204 12932741 1 17774996860857472784 12932764 1 17530677706190505301 19973954 147 18411703205210704868 20653091 64 18113891702278315176 207724 885 18120383051245560448 21040471 1 18195805163564865953 23235685 24 18125438609709967572 23552423 10 18187929524909848470 24536 1 18340473521979893116 29004967 10 18123189275349720619 5084963 1 18131073735751311822 > 174.43 3.65 1.93 0.87 0.84 0.17 0.26 -0.52 -0.14 -1.35 -0.07 0.46 -0.06 -0.07 > 311.892 > 113.3 > 2 5 10 $$$$