@MOLECULE FDBD03144 30 31 0 0 0 SMALL USER_CHARGES @ATOM 1 C -0.0184 1.5028 0.0103 C.3 1 UNK -0.0397 2 C1 0.0021 -0.0041 0.0020 C.ar 1 UNK -0.0503 3 C2 0.0057 -0.6887 -1.1989 C.ar 1 UNK -0.0570 4 C3 0.0245 -2.0709 -1.2065 C.ar 1 UNK -0.0348 5 C4 0.0400 -2.7685 -0.0132 C.ar 1 UNK 0.1085 6 C5 0.0373 -2.0839 1.1877 C.ar 1 UNK -0.0348 7 C6 0.0229 -0.7016 1.1953 C.ar 1 UNK -0.0570 8 S 0.0628 -4.5303 -0.0229 S.O2 1 UNK 0.0723 9 O -0.4695 -4.9453 1.2276 O.2 1 UNK -0.1500 10 O1 -0.4834 -4.9318 -1.2718 O.2 1 UNK -0.1500 11 N 1.6507 -5.0000 -0.0343 N.pl3 1 UNK -0.2163 12 C7 1.9773 -6.3580 -0.0434 C.ar 1 UNK 0.0480 13 C8 0.9712 -7.3158 -0.0489 C.ar 1 UNK -0.0393 14 C9 1.2976 -8.6577 -0.0584 C.ar 1 UNK -0.0600 15 C10 2.6242 -9.0483 -0.0621 C.ar 1 UNK -0.0616 16 C11 3.6281 -8.0973 -0.0568 C.ar 1 UNK -0.0600 17 C12 3.3088 -6.7537 -0.0530 C.ar 1 UNK -0.0393 18 H -0.0184 1.8539 1.0210 H 1 UNK 0.0278 19 H1 -0.8993 1.8503 -0.4880 H 1 UNK 0.0278 20 H2 0.8479 1.8741 -0.4963 H 1 UNK 0.0278 21 H3 -0.0056 -0.1679 -2.0898 H 1 UNK 0.0621 22 H4 0.0270 -2.5820 -2.1031 H 1 UNK 0.0637 23 H5 0.0460 -2.6047 2.0786 H 1 UNK 0.0637 24 H6 0.0277 -0.1904 2.0918 H 1 UNK 0.0621 25 H7 2.3646 -4.3220 -0.0347 H 1 UNK 0.1737 26 H8 -0.0190 -7.0250 -0.0459 H 1 UNK 0.0636 27 H9 0.5507 -9.3698 -0.0627 H 1 UNK 0.0618 28 H10 2.8655 -10.0517 -0.0688 H 1 UNK 0.0618 29 H11 4.6171 -8.3920 -0.0557 H 1 UNK 0.0618 30 H12 4.0585 -6.0445 -0.0573 H 1 UNK 0.0636 @BOND 1 1 2 1 2 2 7 ar 3 2 3 ar 4 3 4 ar 5 4 5 ar 6 5 6 ar 7 5 8 1 8 6 7 ar 9 8 9 2 10 8 10 2 11 8 11 1 12 11 12 1 13 12 17 ar 14 12 13 ar 15 13 14 ar 16 14 15 ar 17 15 16 ar 18 16 17 ar 19 1 18 1 20 1 19 1 21 1 20 1 22 3 21 1 23 4 22 1 24 6 23 1 25 7 24 1 26 11 25 1 27 13 26 1 28 14 27 1 29 15 28 1 30 16 29 1 31 17 30 1