@MOLECULE FDBD02137 37 38 0 0 0 SMALL USER_CHARGES @ATOM 1 C -0.2967 1.3211 0.0864 C.3 1 UNK -0.0411 2 C1 -0.1567 -0.1998 -0.0031 C.3 1 UNK 0.0525 3 O 0.5149 -0.5458 -1.2160 O.3 1 UNK -0.3235 4 P 0.8337 -2.0662 -1.6389 P.3 1 UNK 0.2348 5 S -0.6730 -3.1222 -1.3431 S.2 1 UNK 0.0033 6 O1 1.2274 -2.1180 -3.1991 O.3 1 UNK -0.3235 7 C2 1.8613 -3.2465 -3.8048 C.3 1 UNK 0.0525 8 C3 1.9598 -3.0260 -5.3157 C.3 1 UNK -0.0411 9 S1 2.4491 -2.7988 -0.4777 S.3 1 UNK -0.0016 10 C4 2.5265 -4.5498 -0.9451 C.3 1 UNK 0.2292 11 N 3.5261 -5.2319 -0.1194 N.am 1 UNK 0.0095 12 C5 4.7926 -5.3794 -0.5749 C.2 1 UNK 0.4438 13 O2 5.1263 -4.9544 -1.6657 O.2 1 UNK -0.2114 14 C6 5.7495 -6.0731 0.3008 C.ar 1 UNK 0.1187 15 C7 7.0758 -6.2740 -0.0778 C.ar 1 UNK -0.0426 16 C8 7.9348 -6.9290 0.7770 C.ar 1 UNK -0.0608 17 C9 7.4895 -7.3890 2.0093 C.ar 1 UNK -0.0597 18 C10 6.1838 -7.2009 2.4021 C.ar 1 UNK -0.0334 19 C11 5.2930 -6.5393 1.5528 C.ar 1 UNK 0.1085 20 N1 3.9995 -6.3367 1.9070 N.2 1 UNK -0.0904 21 N2 3.1726 -5.7245 1.1396 N.2 1 UNK 0.1139 22 H -0.7996 1.5801 0.9946 H 1 UNK 0.0252 23 H1 -0.8630 1.6769 -0.7488 H 1 UNK 0.0252 24 H2 0.6746 1.7699 0.0760 H 1 UNK 0.0252 25 H3 -1.1280 -0.6486 0.0073 H 1 UNK 0.0561 26 H4 0.4096 -0.5556 0.8321 H 1 UNK 0.0561 27 H5 1.2850 -4.1267 -3.6096 H 1 UNK 0.0561 28 H6 2.8433 -3.3655 -3.3969 H 1 UNK 0.0561 29 H7 0.9778 -2.9070 -5.7235 H 1 UNK 0.0252 30 H8 2.4344 -3.8709 -5.7693 H 1 UNK 0.0252 31 H9 2.5361 -2.1458 -5.5109 H 1 UNK 0.0252 32 H10 2.7996 -4.6319 -1.9764 H 1 UNK 0.1181 33 H11 1.5690 -5.0023 -0.7926 H 1 UNK 0.1181 34 H12 7.4120 -5.9343 -0.9924 H 1 UNK 0.0627 35 H13 8.9173 -7.0791 0.4993 H 1 UNK 0.0618 36 H14 8.1456 -7.8779 2.6383 H 1 UNK 0.0618 37 H15 5.8640 -7.5471 3.3202 H 1 UNK 0.0640 @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 21 1 12 11 12 am 13 12 13 2 14 12 14 1 15 14 19 ar 16 14 15 ar 17 15 16 ar 18 16 17 ar 19 17 18 ar 20 18 19 ar 21 19 20 1 22 20 21 2 23 1 22 1 24 1 23 1 25 1 24 1 26 2 25 1 27 2 26 1 28 7 27 1 29 7 28 1 30 8 29 1 31 8 30 1 32 8 31 1 33 10 32 1 34 10 33 1 35 15 34 1 36 16 35 1 37 17 36 1 38 18 37 1