@MOLECULE FDBD03028 35 36 0 0 0 SMALL USER_CHARGES @ATOM 1 C -0.0706 1.4534 -0.4281 C.3 1 UNK -0.0440 2 C1 -0.0090 -0.0143 -0.0918 C.2 1 UNK -0.0793 3 C2 1.1400 -0.6431 -0.1112 C.2 1 UNK -0.0806 4 C3 2.4153 0.1248 -0.3461 C.3 1 UNK 0.0029 5 C4 3.3764 -0.1399 0.7840 C.ar 1 UNK 0.0938 6 C5 3.3649 0.6678 1.9098 C.ar 1 UNK 0.1322 7 C6 4.2498 0.4316 2.9597 C.ar 1 UNK -0.0185 8 C7 5.1414 -0.5998 2.8938 C.ar 1 UNK -0.0424 9 C8 5.1666 -1.4259 1.7646 C.ar 1 UNK 0.0714 10 C9 6.1117 -2.5401 1.6665 C.2 1 UNK -0.0336 11 C10 6.0867 -3.3060 0.5448 C.2 1 UNK 0.0811 12 C11 5.1660 -3.0151 -0.4828 C.2 1 UNK 0.4812 13 O 5.1543 -3.7097 -1.4832 O.2 1 UNK -0.1910 14 O1 4.3019 -1.9925 -0.3866 O.3 1 UNK -0.5179 15 C12 4.2712 -1.1957 0.7031 C.ar 1 UNK 0.2809 16 O2 2.4845 1.6979 1.9902 O.3 1 UNK -0.4945 17 C13 2.5231 2.4931 3.1769 C.3 1 UNK 0.0788 18 C14 -1.2694 -0.7587 0.2667 C.3 1 UNK -0.0440 19 H 0.9128 1.8089 -0.6548 H 1 UNK 0.0274 20 H1 -0.4617 1.9948 0.4079 H 1 UNK 0.0274 21 H2 -0.7067 1.5986 -1.2762 H 1 UNK 0.0274 22 H3 1.1719 -1.6643 0.0344 H 1 UNK 0.0575 23 H4 2.1981 1.1715 -0.3918 H 1 UNK 0.0360 24 H5 2.8555 -0.1888 -1.2696 H 1 UNK 0.0360 25 H6 4.2310 1.0405 3.7927 H 1 UNK 0.0654 26 H7 5.7948 -0.7698 3.6743 H 1 UNK 0.0627 27 H8 6.7786 -2.7381 2.4288 H 1 UNK 0.0630 28 H9 6.7399 -4.0987 0.4450 H 1 UNK 0.0748 29 H10 3.7067 -1.8279 -1.0913 H 1 UNK 0.5656 30 H11 1.7846 3.2647 3.1133 H 1 UNK 0.0660 31 H12 3.4924 2.9346 3.2790 H 1 UNK 0.0660 32 H13 2.3213 1.8753 4.0269 H 1 UNK 0.0660 33 H14 -2.1023 -0.0880 0.2302 H 1 UNK 0.0274 34 H15 -1.1778 -1.1603 1.2542 H 1 UNK 0.0274 35 H16 -1.4229 -1.5563 -0.4299 H 1 UNK 0.0274 @BOND 1 1 2 1 2 2 3 2 3 2 18 1 4 3 4 1 5 4 5 1 6 5 15 ar 7 5 6 ar 8 6 7 ar 9 6 16 1 10 7 8 ar 11 8 9 ar 12 9 15 ar 13 9 10 1 14 10 11 2 15 11 12 1 16 12 13 2 17 12 14 1 18 14 15 1 19 16 17 1 20 1 19 1 21 1 20 1 22 1 21 1 23 3 22 1 24 4 23 1 25 4 24 1 26 7 25 1 27 8 26 1 28 10 27 1 29 11 28 1 30 14 29 1 31 17 30 1 32 17 31 1 33 17 32 1 34 18 33 1 35 18 34 1 36 18 35 1