@MOLECULE FDBD02340 43 43 0 0 0 SMALL USER_CHARGES @ATOM 1 C -1.0151 1.9019 -0.8253 C.3 1 UNK -0.0559 2 C1 -1.0112 0.3787 -0.6807 C.3 1 UNK -0.0092 3 C2 -0.6166 0.0032 0.7490 C.3 1 UNK -0.0559 4 C3 -2.4085 -0.1659 -0.9839 C.3 1 UNK -0.0559 5 C4 -0.0198 -0.2152 -1.6479 C.ar 1 UNK 0.0003 6 C5 0.7075 0.6046 -2.4717 C.ar 1 UNK -0.0474 7 C6 1.6294 0.0505 -3.3710 C.ar 1 UNK -0.0224 8 C7 2.4100 0.9210 -4.2537 C.2 1 UNK -0.0268 9 C8 2.7505 2.1906 -3.8433 C.2 1 UNK 0.1287 10 C9 3.3790 3.0946 -4.7589 C.1 1 UNK 0.1102 11 N 3.8776 3.8118 -5.4852 N.1 1 UNK -0.1901 12 C10 2.4761 2.6068 -2.5009 C.1 1 UNK 0.1102 13 N1 2.2584 2.9369 -1.4359 N.1 1 UNK -0.1901 14 C11 1.8017 -1.3400 -3.4219 C.ar 1 UNK -0.0474 15 C12 1.0686 -2.1495 -2.5930 C.ar 1 UNK 0.0003 16 C13 0.1596 -1.5935 -1.6990 C.ar 1 UNK 0.1242 17 O -0.5632 -2.3998 -0.8811 O.3 1 UNK -0.5062 18 C14 1.2525 -3.6443 -2.6464 C.3 1 UNK -0.0092 19 C15 2.3061 -3.9912 -3.7002 C.3 1 UNK -0.0559 20 C16 1.7136 -4.1505 -1.2782 C.3 1 UNK -0.0559 21 C17 -0.0755 -4.3087 -3.0150 C.3 1 UNK -0.0559 22 H -1.7190 2.3236 -0.1386 H 1 UNK 0.0238 23 H1 -1.2911 2.1645 -1.8252 H 1 UNK 0.0238 24 H2 -0.0379 2.2828 -0.6133 H 1 UNK 0.0238 25 H3 -1.3205 0.4249 1.4357 H 1 UNK 0.0238 26 H4 0.3606 0.3841 0.9610 H 1 UNK 0.0238 27 H5 -0.6139 -1.0620 0.8502 H 1 UNK 0.0238 28 H6 -3.1124 0.2558 -0.2972 H 1 UNK 0.0238 29 H7 -2.4058 -1.2311 -0.8828 H 1 UNK 0.0238 30 H8 -2.6845 0.0968 -1.9838 H 1 UNK 0.0238 31 H9 0.5766 1.6274 -2.4299 H 1 UNK 0.0627 32 H10 2.7047 0.5827 -5.1831 H 1 UNK 0.0643 33 H11 2.4789 -1.7533 -4.0819 H 1 UNK 0.0627 34 H12 -1.1761 -2.0273 -0.2781 H 1 UNK 0.2922 35 H13 3.2348 -3.5266 -3.4424 H 1 UNK 0.0238 36 H14 1.9836 -3.6371 -4.6570 H 1 UNK 0.0238 37 H15 2.4367 -5.0525 -3.7381 H 1 UNK 0.0238 38 H16 2.6423 -3.6858 -1.0204 H 1 UNK 0.0238 39 H17 1.8442 -5.2118 -1.3160 H 1 UNK 0.0238 40 H18 0.9768 -3.9079 -0.5413 H 1 UNK 0.0238 41 H19 -0.3979 -3.9547 -3.9719 H 1 UNK 0.0238 42 H20 -0.8124 -4.0661 -2.2781 H 1 UNK 0.0238 43 H21 0.0551 -5.3700 -3.0528 H 1 UNK 0.0238 @BOND 1 1 2 1 2 2 3 1 3 2 4 1 4 2 5 1 5 5 16 ar 6 5 6 ar 7 6 7 ar 8 7 8 1 9 7 14 ar 10 8 9 2 11 9 10 1 12 9 12 1 13 10 11 3 14 12 13 3 15 14 15 ar 16 15 16 ar 17 15 18 1 18 16 17 1 19 18 19 1 20 18 20 1 21 18 21 1 22 1 22 1 23 1 23 1 24 1 24 1 25 3 25 1 26 3 26 1 27 3 27 1 28 4 28 1 29 4 29 1 30 4 30 1 31 6 31 1 32 8 32 1 33 14 33 1 34 17 34 1 35 19 35 1 36 19 36 1 37 19 37 1 38 20 38 1 39 20 39 1 40 20 40 1 41 21 41 1 42 21 42 1 43 21 43 1