@MOLECULE 71587783 33 34 1 SMALL USER_CHARGES @ATOM 1 Hg1 -1.6014 -0.8781 -1.7326 Hg 1 noname 0.0722 2 O1 -0.4530 -3.9268 -1.0501 O.3 1 noname -0.3817 3 O2 -0.8349 -4.0896 3.4077 O.3 1 noname -0.1442 4 O3 0.9640 -4.0300 4.8038 O.2 1 noname -0.2454 5 O4 -1.0152 -2.1232 7.7246 O.3 1 noname -0.2133 6 O5 0.4927 -3.7487 7.3290 O.2 1 noname -0.2507 7 C1 -1.8501 -4.6488 0.7754 C.3 1 noname 0.0344 8 C2 -1.2849 -3.4569 0.0004 C.3 1 noname 0.0532 9 C3 -2.7054 -4.1657 1.8555 C.2 1 noname -0.0105 10 C4 -2.1752 -3.8922 3.1465 C.2 1 noname 0.0143 11 C5 -3.0253 -3.3971 4.2088 C.2 1 noname -0.0030 12 C6 -4.0992 -3.9524 1.6517 C.2 1 noname -0.0496 13 C7 -2.4362 -2.6388 -0.5879 C.3 1 noname -0.0642 14 C8 -4.4144 -3.1679 3.9893 C.2 1 noname -0.0435 15 C9 -4.9372 -3.4654 2.6940 C.2 1 noname -0.0613 16 C10 -2.4360 -3.1373 5.4699 C.2 1 noname 0.0469 17 C11 -1.0570 -3.3507 5.6943 C.2 1 noname 0.1359 18 C12 -0.2587 -3.8346 4.6321 C.2 1 noname 0.1475 19 C13 0.6155 -4.6860 -0.5041 C.3 1 noname 0.0359 20 C14 -0.4948 -3.0893 6.9383 C.2 1 noname 0.1290 21 H1 -2.4345 -5.2759 0.1021 H 1 noname 0.0343 22 H2 -1.0299 -5.2316 1.1945 H 1 noname 0.0343 23 H3 -0.7006 -2.8298 0.6738 H 1 noname 0.0598 24 H4 -4.5058 -4.1532 0.7380 H 1 noname 0.0626 25 H5 -3.0748 -2.2781 0.2185 H 1 noname 0.0188 26 H6 -3.0206 -3.2659 -1.2612 H 1 noname 0.0188 27 H7 -5.0137 -2.8046 4.7304 H 1 noname 0.0629 28 H8 -5.9311 -3.3261 2.5122 H 1 noname 0.0622 29 H9 -3.0183 -2.7892 6.2316 H 1 noname 0.0640 30 H10 1.2541 -5.0468 -1.3105 H 1 noname 0.0529 31 H11 0.2129 -5.5352 0.0480 H 1 noname 0.0529 32 H12 1.1999 -4.0590 0.1692 H 1 noname 0.0529 33 H13 -0.9574 -2.2010 8.6998 H 1 noname 0.2216 @BOND 1 1 13 1 2 2 8 1 3 2 19 1 4 3 10 1 5 3 18 1 6 4 18 2 7 5 20 1 8 5 33 1 9 6 20 2 10 7 8 1 11 7 9 1 12 7 21 1 13 7 22 1 14 8 13 1 15 8 23 1 16 9 10 1 17 9 12 2 18 10 11 2 19 11 14 1 20 11 16 1 21 12 15 1 22 12 24 1 23 13 25 1 24 13 26 1 25 14 15 2 26 14 27 1 27 15 28 1 28 16 17 2 29 16 29 1 30 17 18 1 31 17 20 1 32 19 30 1 33 19 31 1 34 19 32 1 @SUBSTRUCTURE 1 noname 1