@MOLECULE FDBD02397 39 41 0 0 0 SMALL USER_CHARGES @ATOM 1 C -0.0449 1.5760 0.0816 C.3 1 UNK -0.0191 2 C1 -0.0988 0.0999 -0.3174 C.3 1 UNK 0.1729 3 C2 -1.5322 -0.3649 -0.3302 C.2 1 UNK 0.2577 4 O -2.0493 -0.7076 -1.3724 O.2 1 UNK -0.2714 5 N -2.2397 -0.3998 0.8164 N.am 1 UNK -0.2825 6 C3 -3.5967 -0.7398 0.7912 C.ar 1 UNK 0.0335 7 C4 -4.4870 -0.1141 1.6540 C.ar 1 UNK -0.0405 8 C5 -5.8259 -0.4520 1.6267 C.ar 1 UNK -0.0600 9 C6 -6.2802 -1.4122 0.7413 C.ar 1 UNK -0.0616 10 C7 -5.3962 -2.0373 -0.1189 C.ar 1 UNK -0.0600 11 C8 -4.0572 -1.6995 -0.1007 C.ar 1 UNK -0.0405 12 O1 0.4663 -0.0624 -1.6198 O.3 1 UNK -0.4799 13 C9 1.8184 -0.1745 -1.6961 C.ar 1 UNK 0.1222 14 C10 2.5778 -0.1788 -0.5218 C.ar 1 UNK -0.0193 15 C11 3.9324 -0.2896 -0.5658 C.ar 1 UNK -0.0506 16 C12 4.5828 -0.4020 -1.8071 C.ar 1 UNK -0.0177 17 C13 5.9808 -0.5186 -1.8890 C.ar 1 UNK -0.0540 18 C14 6.5777 -0.6260 -3.1074 C.ar 1 UNK -0.0612 19 C15 5.8231 -0.6223 -4.2792 C.ar 1 UNK -0.0612 20 C16 4.4674 -0.5111 -4.2389 C.ar 1 UNK -0.0539 21 C17 3.8152 -0.3982 -2.9987 C.ar 1 UNK -0.0144 22 C18 2.4174 -0.2870 -2.9183 C.ar 1 UNK -0.0122 23 H 0.9920 1.9122 0.0909 H 1 UNK 0.0270 24 H1 -0.6122 2.1676 -0.6369 H 1 UNK 0.0270 25 H2 -0.4759 1.6998 1.0751 H 1 UNK 0.0270 26 H3 0.4686 -0.4916 0.4011 H 1 UNK 0.0829 27 H4 -1.8080 -0.1892 1.6592 H 1 UNK 0.1549 28 H5 -4.1327 0.6356 2.3460 H 1 UNK 0.0636 29 H6 -6.5187 0.0339 2.2977 H 1 UNK 0.0618 30 H7 -7.3277 -1.6746 0.7219 H 1 UNK 0.0618 31 H8 -5.7541 -2.7871 -0.8089 H 1 UNK 0.0618 32 H9 -3.3673 -2.1879 -0.7730 H 1 UNK 0.0636 33 H10 2.0815 -0.0926 0.4335 H 1 UNK 0.0654 34 H11 4.5063 -0.2908 0.3491 H 1 UNK 0.0625 35 H12 6.5787 -0.5226 -0.9896 H 1 UNK 0.0624 36 H13 7.6524 -0.7152 -3.1672 H 1 UNK 0.0618 37 H14 6.3217 -0.7085 -5.2333 H 1 UNK 0.0618 38 H15 3.8954 -0.5093 -5.1550 H 1 UNK 0.0624 39 H16 1.8200 -0.2869 -3.8180 H 1 UNK 0.0660 @BOND 1 1 2 1 2 1 23 1 3 1 24 1 4 1 25 1 5 2 3 1 6 2 12 1 7 2 26 1 8 3 4 2 9 3 5 am 10 5 6 1 11 5 27 1 12 6 11 ar 13 6 7 ar 14 7 8 ar 15 7 28 1 16 8 9 ar 17 8 29 1 18 9 10 ar 19 9 30 1 20 10 11 ar 21 10 31 1 22 11 32 1 23 12 13 1 24 13 22 ar 25 13 14 ar 26 14 15 ar 27 14 33 1 28 15 16 ar 29 15 34 1 30 16 21 ar 31 16 17 ar 32 17 18 ar 33 17 35 1 34 18 19 ar 35 18 36 1 36 19 20 ar 37 19 37 1 38 20 21 ar 39 20 38 1 40 21 22 ar 41 22 39 1