@MOLECULE FDBD03263 36 37 0 0 0 SMALL USER_CHARGES @ATOM 1 C -0.0187 1.5258 0.0104 C.3 1 UNK -0.0594 2 C1 0.0021 -0.0041 0.0020 C.3 1 UNK 0.0076 3 C2 -1.4333 -0.5336 0.0129 C.3 1 UNK 0.1949 4 N -1.4134 -1.9985 0.0048 N.am 1 UNK 0.0938 5 C3 -1.4099 -2.6630 -1.1741 C.2 1 UNK 0.4612 6 O -1.4230 -2.0664 -2.2351 O.2 1 UNK -0.2097 7 C4 -1.3893 -4.1314 -1.1255 C.ar 1 UNK 0.1237 8 C5 -1.3836 -4.9071 -2.2839 C.ar 1 UNK -0.0293 9 C6 -1.3636 -6.2809 -2.1777 C.ar 1 UNK 0.0144 10 C7 -1.3491 -6.8930 -0.9304 C.ar 1 UNK -0.0464 11 C8 -1.3543 -6.1511 0.2169 C.ar 1 UNK -0.0301 12 C9 -1.3744 -4.7561 0.1418 C.ar 1 UNK 0.1380 13 N1 -1.3797 -3.9850 1.2560 N.2 1 UNK 0.0387 14 C10 -1.3930 -2.6804 1.1845 C.cat 1 UNK 0.7080 15 O1 -1.3975 -1.9740 2.3350 O.2 1 UNK -0.2522 16 C11 -1.3873 -2.7195 3.5540 C.3 1 UNK 0.1514 17 C12 -1.3944 -1.7550 4.7417 C.3 1 UNK -0.0162 18 C13 -1.3835 -2.5532 6.0470 C.3 1 UNK -0.0620 19 I -1.3556 -7.4566 -3.9117 I 1 UNK -0.0438 20 H 0.9851 1.8962 0.0028 H 1 UNK 0.0232 21 H1 -0.5195 1.8709 0.8907 H 1 UNK 0.0232 22 H2 -0.5362 1.8802 -0.8564 H 1 UNK 0.0232 23 H3 0.5196 -0.3586 0.8689 H 1 UNK 0.0325 24 H4 0.5029 -0.3492 -0.8783 H 1 UNK 0.0325 25 H5 -1.9508 -0.1791 -0.8539 H 1 UNK 0.1067 26 H6 -1.9341 -0.1885 0.8932 H 1 UNK 0.1067 27 H7 -1.3943 -4.4566 -3.2123 H 1 UNK 0.0638 28 H8 -1.3342 -7.9231 -0.8697 H 1 UNK 0.0629 29 H9 -1.3434 -6.6198 1.1363 H 1 UNK 0.0641 30 H10 -0.5074 -3.3271 3.5932 H 1 UNK 0.0752 31 H11 -2.2546 -3.3447 3.5970 H 1 UNK 0.0752 32 H12 -2.2743 -1.1474 4.7025 H 1 UNK 0.0297 33 H13 -0.5271 -1.1299 4.6987 H 1 UNK 0.0297 34 H14 -2.2508 -3.1783 6.0900 H 1 UNK 0.0231 35 H15 -1.3885 -1.8787 6.8776 H 1 UNK 0.0231 36 H16 -0.5036 -3.1608 6.0862 H 1 UNK 0.0231 @BOND 1 1 2 1 2 2 3 1 3 3 4 1 4 4 14 1 5 4 5 am 6 5 6 2 7 5 7 1 8 7 12 ar 9 7 8 ar 10 8 9 ar 11 9 10 ar 12 9 19 1 13 10 11 ar 14 11 12 ar 15 12 13 1 16 13 14 2 17 14 15 1 18 15 16 1 19 16 17 1 20 17 18 1 21 1 20 1 22 1 21 1 23 1 22 1 24 2 23 1 25 2 24 1 26 3 25 1 27 3 26 1 28 8 27 1 29 10 28 1 30 11 29 1 31 16 30 1 32 16 31 1 33 17 32 1 34 17 33 1 35 18 34 1 36 18 35 1 37 18 36 1