@MOLECULE FDBD02107 36 35 0 0 0 SMALL USER_CHARGES @ATOM 1 C -0.1024 1.6075 -0.9686 C.3 1 UNK -0.0411 2 C1 -0.1574 0.1223 -0.6055 C.3 1 UNK 0.0525 3 O 0.7539 -0.6043 -1.4324 O.3 1 UNK -0.3236 4 P 0.8454 -2.2117 -1.4345 P.3 1 UNK 0.2299 5 S -0.8731 -2.9316 -1.4725 S.2 1 UNK 0.0032 6 O1 1.6611 -2.7011 -2.7335 O.3 1 UNK -0.3236 7 C2 1.6529 -4.0539 -3.1936 C.3 1 UNK 0.0525 8 C3 2.5268 -4.1727 -4.4439 C.3 1 UNK -0.0411 9 S1 1.8466 -2.8649 0.3162 S.3 1 UNK -0.0631 10 C4 0.6866 -2.4226 1.6388 C.3 1 UNK 0.0488 11 S2 -0.7113 -3.5787 1.6286 S.3 1 UNK -0.1436 12 C5 -0.0012 -5.0840 2.3498 C.3 1 UNK 0.0090 13 C6 0.5032 -4.7837 3.7627 C.3 1 UNK -0.0509 14 C7 -1.0728 -6.1744 2.4118 C.3 1 UNK -0.0509 15 C8 1.1649 -5.5637 1.4832 C.3 1 UNK -0.0509 16 H -0.7847 2.1515 -0.3495 H 1 UNK 0.0252 17 H1 -0.3743 1.7339 -1.9957 H 1 UNK 0.0252 18 H2 0.8903 1.9758 -0.8146 H 1 UNK 0.0252 19 H3 -1.1501 -0.2460 -0.7595 H 1 UNK 0.0561 20 H4 0.1145 -0.0041 0.4216 H 1 UNK 0.0561 21 H5 0.6505 -4.3441 -3.4302 H 1 UNK 0.0561 22 H6 2.0380 -4.6936 -2.4272 H 1 UNK 0.0561 23 H7 2.1417 -3.5330 -5.2103 H 1 UNK 0.0252 24 H8 2.5207 -5.1857 -4.7884 H 1 UNK 0.0252 25 H9 3.5292 -3.8825 -4.2073 H 1 UNK 0.0252 26 H10 0.3274 -1.4272 1.4801 H 1 UNK 0.0494 27 H11 1.1860 -2.4751 2.5836 H 1 UNK 0.0494 28 H12 -0.3123 -4.4482 4.3688 H 1 UNK 0.0243 29 H13 1.2526 -4.0212 3.7193 H 1 UNK 0.0243 30 H14 0.9221 -5.6717 4.1881 H 1 UNK 0.0243 31 H15 -1.8883 -5.8390 3.0178 H 1 UNK 0.0243 32 H16 -0.6539 -7.0624 2.8372 H 1 UNK 0.0243 33 H17 -1.4255 -6.3844 1.4237 H 1 UNK 0.0243 34 H18 1.9143 -4.8012 1.4398 H 1 UNK 0.0243 35 H19 0.8121 -5.7737 0.4951 H 1 UNK 0.0243 36 H20 1.5838 -6.4517 1.9086 H 1 UNK 0.0243 @BOND 1 1 2 1 2 2 3 1 3 3 4 1 4 4 5 2 5 4 6 1 6 4 9 1 7 6 7 1 8 7 8 1 9 9 10 1 10 10 11 1 11 11 12 1 12 12 13 1 13 12 14 1 14 12 15 1 15 1 16 1 16 1 17 1 17 1 18 1 18 2 19 1 19 2 20 1 20 7 21 1 21 7 22 1 22 8 23 1 23 8 24 1 24 8 25 1 25 10 26 1 26 10 27 1 27 13 28 1 28 13 29 1 29 13 30 1 30 14 31 1 31 14 32 1 32 14 33 1 33 15 34 1 34 15 35 1 35 15 36 1