@MOLECULE FDBD02909 49 52 0 0 0 SMALL USER_CHARGES @ATOM 1 C -0.0078 1.5020 -0.0975 C.3 1 UNK -0.0624 2 C1 0.0078 -0.0279 -0.0865 C.3 1 UNK -0.0428 3 C2 0.7578 -0.5213 1.1524 C.3 1 UNK -0.0624 4 C3 -1.4292 -0.5523 -0.0552 C.3 1 UNK -0.0250 5 C4 -2.1453 -0.4198 -1.4496 C.3 1 UNK -0.0119 6 C5 -1.2030 -1.2991 -2.3316 C.3 1 UNK -0.0454 7 C6 -0.7645 -2.4435 -1.3865 C.3 1 UNK -0.0453 8 C7 -1.4926 -2.1241 -0.0424 C.3 1 UNK -0.0102 9 C8 -2.9749 -2.3321 -0.3578 C.ar 1 UNK -0.0193 10 C9 -3.3681 -1.3059 -1.2050 C.ar 1 UNK -0.0388 11 C10 -4.6666 -1.2394 -1.6561 C.ar 1 UNK -0.0579 12 C11 -5.5834 -2.2005 -1.2628 C.ar 1 UNK -0.0597 13 C12 -5.1982 -3.2241 -0.4196 C.ar 1 UNK -0.0402 14 C13 -3.8860 -3.2930 0.0375 C.ar 1 UNK 0.0374 15 N -3.4916 -4.3279 0.8917 N.am 1 UNK -0.2812 16 C14 -4.3600 -4.8239 1.7952 C.2 1 UNK 0.2517 17 O -5.4503 -4.3048 1.9392 O.2 1 UNK -0.2697 18 C15 -3.9883 -5.9956 2.6087 C.ar 1 UNK 0.0831 19 C16 -2.7910 -6.6811 2.5593 C.ar 1 UNK 0.0378 20 N1 -2.8607 -7.6767 3.4574 N.ar 1 UNK -0.2733 21 C17 -1.8049 -8.6534 3.7363 C.3 1 UNK 0.0302 22 N2 -4.1115 -7.6239 4.0825 N.ar 1 UNK -0.1700 23 C18 -4.7884 -6.6237 3.5895 C.ar 1 UNK 0.1401 24 C19 -6.1830 -6.2157 3.9889 C.3 1 UNK 0.2832 25 F -6.4010 -6.5507 5.3296 F 1 UNK -0.2022 26 F1 -6.3302 -4.8343 3.8235 F 1 UNK -0.2022 27 H 1.0159 1.8757 -0.1198 H 1 UNK 0.0232 28 H1 -0.5422 1.8536 -0.9801 H 1 UNK 0.0232 29 H2 -0.5083 1.8668 0.7995 H 1 UNK 0.0232 30 H3 0.5083 -0.3926 -0.9835 H 1 UNK 0.0299 31 H4 0.2574 -0.1566 2.0494 H 1 UNK 0.0232 32 H5 0.7689 -1.6112 1.1603 H 1 UNK 0.0232 33 H6 1.7816 -0.1477 1.1301 H 1 UNK 0.0232 34 H7 -2.0081 -0.1072 0.7539 H 1 UNK 0.0315 35 H8 -2.3459 0.5924 -1.8007 H 1 UNK 0.0352 36 H9 -1.7448 -1.6981 -3.1891 H 1 UNK 0.0271 37 H10 -0.3384 -0.7220 -2.6596 H 1 UNK 0.0271 38 H11 -1.0896 -3.4076 -1.7775 H 1 UNK 0.0271 39 H12 0.3165 -2.4313 -1.2477 H 1 UNK 0.0271 40 H13 -1.1032 -2.6208 0.8463 H 1 UNK 0.0352 41 H14 -4.9703 -0.4395 -2.3151 H 1 UNK 0.0620 42 H15 -6.6026 -2.1489 -1.6164 H 1 UNK 0.0618 43 H16 -5.9158 -3.9714 -0.1150 H 1 UNK 0.0636 44 H17 -2.5930 -4.6887 0.8338 H 1 UNK 0.1551 45 H18 -1.9524 -6.4576 1.9165 H 1 UNK 0.0834 46 H19 -1.1572 -8.2727 4.5260 H 1 UNK 0.0473 47 H20 -2.2548 -9.5931 4.0568 H 1 UNK 0.0473 48 H21 -1.2174 -8.8211 2.8336 H 1 UNK 0.0473 49 H22 -6.9073 -6.7358 3.3620 H 1 UNK 0.1089 @BOND 1 1 2 1 2 1 27 1 3 1 28 1 4 1 29 1 5 2 3 1 6 2 4 1 7 2 30 1 8 3 31 1 9 3 32 1 10 3 33 1 11 4 8 1 12 4 5 1 13 4 34 1 14 5 10 1 15 5 6 1 16 5 35 1 17 6 7 1 18 6 36 1 19 6 37 1 20 7 8 1 21 7 38 1 22 7 39 1 23 8 9 1 24 8 40 1 25 9 14 ar 26 9 10 ar 27 10 11 ar 28 11 12 ar 29 11 41 1 30 12 13 ar 31 12 42 1 32 13 14 ar 33 13 43 1 34 14 15 1 35 15 16 am 36 15 44 1 37 16 17 2 38 16 18 1 39 18 23 ar 40 18 19 ar 41 19 20 ar 42 19 45 1 43 20 21 1 44 20 22 ar 45 21 46 1 46 21 47 1 47 21 48 1 48 22 23 ar 49 23 24 1 50 24 25 1 51 24 26 1 52 24 49 1