@MOLECULE FDBD02212 34 34 0 0 0 SMALL USER_CHARGES @ATOM 1 C -0.0187 1.5258 0.0104 C.3 1 UNK -0.0280 2 C1 0.0021 -0.0041 0.0020 C.3 1 UNK 0.0978 3 C2 0.7182 -0.4975 -1.2568 C.3 1 UNK -0.0280 4 O 0.7043 -0.4851 1.1784 O.3 1 UNK -0.4583 5 C3 -0.0337 -0.7051 2.2841 C.2 1 UNK 0.3430 6 O1 -1.2313 -0.5006 2.2658 O.2 1 UNK -0.2448 7 C4 0.6118 -1.1938 3.5158 C.ar 1 UNK 0.1009 8 C5 1.9899 -1.4249 3.5432 C.ar 1 UNK -0.0442 9 C6 2.5870 -1.8818 4.6977 C.ar 1 UNK -0.0608 10 C7 1.8274 -2.1140 5.8330 C.ar 1 UNK -0.0583 11 C8 0.4652 -1.8900 5.8201 C.ar 1 UNK -0.0187 12 C9 -0.1521 -1.4242 4.6687 C.ar 1 UNK 0.1427 13 O2 -1.4903 -1.2036 4.6546 O.3 1 UNK -0.4337 14 P -1.9426 0.1291 5.4365 P.3 1 UNK 0.2914 15 S -1.8456 -0.1656 7.2740 S.2 1 UNK 0.0220 16 N -0.9212 1.3994 5.0173 N.3 1 UNK -0.2529 17 O3 -3.4559 0.5013 5.0318 O.3 1 UNK -0.3145 18 C10 -4.0422 1.7764 5.3008 C.3 1 UNK 0.0455 19 H -0.5362 1.8802 -0.8565 H 1 UNK 0.0265 20 H1 0.9851 1.8962 0.0029 H 1 UNK 0.0265 21 H2 -0.5196 1.8709 0.8907 H 1 UNK 0.0265 22 H3 -1.0017 -0.3745 0.0096 H 1 UNK 0.0728 23 H4 1.7220 -0.1271 -1.2644 H 1 UNK 0.0265 24 H5 0.2007 -0.1431 -2.1236 H 1 UNK 0.0265 25 H6 0.7327 -1.5674 -1.2627 H 1 UNK 0.0265 26 H7 2.5594 -1.2535 2.6998 H 1 UNK 0.0627 27 H8 3.6047 -2.0519 4.7170 H 1 UNK 0.0618 28 H9 2.2827 -2.4565 6.6935 H 1 UNK 0.0619 29 H10 -0.0946 -2.0694 6.6683 H 1 UNK 0.0654 30 H11 0.0375 1.1636 5.2737 H 1 UNK 0.1283 31 H12 -1.2078 2.2437 5.5126 H 1 UNK 0.1283 32 H13 -5.0503 1.7882 4.9423 H 1 UNK 0.0529 33 H14 -3.4787 2.5396 4.8059 H 1 UNK 0.0529 34 H15 -4.0366 1.9562 6.3556 H 1 UNK 0.0529 @BOND 1 1 2 1 2 2 3 1 3 2 4 1 4 4 5 1 5 5 6 2 6 5 7 1 7 7 12 ar 8 7 8 ar 9 8 9 ar 10 9 10 ar 11 10 11 ar 12 11 12 ar 13 12 13 1 14 13 14 1 15 14 15 2 16 14 16 1 17 14 17 1 18 17 18 1 19 1 19 1 20 1 20 1 21 1 21 1 22 2 22 1 23 3 23 1 24 3 24 1 25 3 25 1 26 8 26 1 27 9 27 1 28 10 28 1 29 11 29 1 30 16 30 1 31 16 31 1 32 18 32 1 33 18 33 1 34 18 34 1