@MOLECULE DB03155 33 34 1 SMALL USER_CHARGES @ATOM 1 P1 0.1951 -2.1205 -4.0348 P 1 noname 0.0166 2 O1 0.2732 -1.2543 -5.1824 O.2 1 noname -0.1963 3 O2 -0.3313 -1.3247 -2.8259 O.3 1 noname -0.1480 4 O3 1.5954 -2.6751 -3.7139 O.3 1 noname -0.1643 5 O4 -0.7626 -3.2880 -4.3371 O.3 1 noname -0.1643 6 C1 -0.4083 -2.1789 -1.6942 C.3 1 noname 0.1368 7 C2 -0.9238 -1.3996 -0.5102 C.3 1 noname 0.1701 8 C3 -1.5115 -3.2305 -1.9187 C.3 1 noname 0.1130 9 F1 -0.5298 -0.0908 -0.6180 F 1 noname -0.2398 10 C4 -2.4205 -1.5018 -0.7684 C.3 1 noname 0.1567 11 O5 -2.6504 -2.8768 -1.1356 O.3 1 noname -0.3505 12 C5 -1.0011 -4.6059 -1.4842 C.3 1 noname 0.0722 13 N1 -3.2002 -1.0118 0.3381 N.3 1 noname 0.0575 14 O6 -2.0180 -5.5752 -1.6912 O.3 1 noname -0.3934 15 C6 -3.5834 -1.8205 1.3960 C.2 1 noname 0.1092 16 C7 -3.5044 0.3435 0.3376 C.2 1 noname -0.0430 17 O7 -3.3209 -3.0427 1.4000 O.2 1 noname -0.2474 18 N2 -4.2571 -1.2417 2.4351 N.2 1 noname -0.1286 19 C8 -4.1965 0.9887 1.4056 C.2 1 noname 0.0228 20 C9 -4.5577 0.0946 2.4607 C.2 1 noname 0.0411 21 O8 -5.2229 0.5876 3.5270 O.3 1 noname -0.2572 22 H1 1.7111 -2.7209 -2.7620 H 1 noname 0.2283 23 H2 -1.0742 -3.6680 -3.5124 H 1 noname 0.2283 24 H3 0.6059 -2.5618 -1.5809 H 1 noname 0.0674 25 H4 -0.5498 -1.6716 0.4768 H 1 noname 0.0733 26 H5 -1.8524 -3.2520 -2.9538 H 1 noname 0.0657 27 H6 -2.8115 -0.8737 -1.5688 H 1 noname 0.0819 28 H7 -0.1879 -4.8905 -2.1518 H 1 noname 0.0591 29 H8 -0.8383 -4.5807 -0.4068 H 1 noname 0.0591 30 H9 -2.3426 -5.8846 -0.8423 H 1 noname 0.2101 31 H10 -3.1890 0.9209 -0.5313 H 1 noname 0.0759 32 H11 -4.4255 2.0543 1.4145 H 1 noname 0.0677 33 H12 -5.5555 -0.1382 4.0601 H 1 noname 0.2199 @BOND 1 1 2 2 2 1 3 1 3 1 4 1 4 1 5 1 5 6 3 1 6 6 7 1 7 6 8 1 8 7 9 1 9 7 10 1 10 8 11 1 11 8 12 1 12 10 13 1 13 10 11 1 14 12 14 1 15 13 15 1 16 13 16 1 17 15 17 2 18 15 18 1 19 16 19 2 20 18 20 2 21 19 20 1 22 20 21 1 23 4 22 1 24 5 23 1 25 6 24 1 26 7 25 1 27 8 26 1 28 10 27 1 29 12 28 1 30 12 29 1 31 14 30 1 32 16 31 1 33 19 32 1 34 21 33 1 @SUBSTRUCTURE 1 noname 1