@MOLECULE FDBD02924 54 54 0 0 0 SMALL USER_CHARGES @ATOM 1 C 0.8904 -0.8290 1.0194 C.3 1 UNK -0.0605 2 C1 0.1718 -0.1870 -0.1690 C.3 1 UNK -0.0196 3 C2 0.9693 -0.4474 -1.4485 C.3 1 UNK -0.0605 4 C3 -1.2264 -0.7928 -0.3073 C.3 1 UNK 0.1048 5 H -1.7613 -0.6914 0.6370 H 1 UNK 0.0598 6 C4 -1.9818 -0.0701 -1.3927 C.2 1 UNK 0.2342 7 O -2.0905 -0.5704 -2.4922 O.2 1 UNK -0.2738 8 N -2.5367 1.1322 -1.1417 N.am 1 UNK -0.3064 9 C5 -3.3156 1.8107 -2.1804 C.3 1 UNK 0.0584 10 C6 -4.8056 1.7106 -1.8477 C.3 1 UNK 0.0674 11 C7 -5.2275 0.2639 -1.8623 C.2 1 UNK 0.3089 12 O1 -4.4123 -0.6009 -2.0803 O.2 1 UNK -0.2508 13 O2 -6.5087 -0.0639 -1.6330 O.3 1 UNK -0.4679 14 C8 -6.8431 -1.4766 -1.6624 C.3 1 UNK 0.0817 15 C9 -2.9116 3.2612 -2.2444 C.ar 1 UNK -0.0266 16 C10 -2.6577 3.9597 -1.0788 C.ar 1 UNK -0.0554 17 C11 -2.2871 5.2900 -1.1369 C.ar 1 UNK -0.0431 18 C12 -2.1703 5.9225 -2.3618 C.ar 1 UNK 0.0410 19 C13 -2.4245 5.2228 -3.5280 C.ar 1 UNK -0.0431 20 C14 -2.7896 3.8910 -3.4689 C.ar 1 UNK -0.0554 21 Cl -1.7054 7.5934 -2.4355 Cl 1 UNK -0.0835 22 N1 -1.1118 -2.2116 -0.6537 N.am 1 UNK -0.2696 23 C15 -0.9502 -3.1316 0.3178 C.2 1 UNK 0.4011 24 O3 -0.8995 -2.7842 1.4811 O.2 1 UNK -0.2265 25 O4 -0.8448 -4.4355 -0.0005 O.3 1 UNK -0.4477 26 C16 -0.6726 -5.3703 1.0971 C.3 1 UNK 0.0991 27 C17 -2.0438 -5.8398 1.5871 C.3 1 UNK -0.0279 28 C18 0.1380 -6.5761 0.6177 C.3 1 UNK -0.0279 29 H1 1.8343 -0.3130 1.1952 H 1 UNK 0.0233 30 H2 0.2635 -0.7523 1.9078 H 1 UNK 0.0233 31 H3 1.0855 -1.8792 0.8019 H 1 UNK 0.0233 32 H4 0.0877 0.8874 -0.0055 H 1 UNK 0.0318 33 H5 1.0533 -1.5217 -1.6119 H 1 UNK 0.0233 34 H6 0.4573 0.0100 -2.2951 H 1 UNK 0.0233 35 H7 1.9653 -0.0158 -1.3499 H 1 UNK 0.0233 36 H8 -2.4202 1.5483 -0.2732 H 1 UNK 0.1494 37 H9 -3.1259 1.3379 -3.1440 H 1 UNK 0.0553 38 H10 -4.9862 2.1318 -0.8588 H 1 UNK 0.0399 39 H11 -5.3815 2.2644 -2.5892 H 1 UNK 0.0399 40 H12 -6.6075 -1.8854 -2.6450 H 1 UNK 0.0661 41 H13 -6.2657 -2.0026 -0.9021 H 1 UNK 0.0661 42 H14 -7.9072 -1.6024 -1.4621 H 1 UNK 0.0661 43 H15 -2.7492 3.4660 -0.1227 H 1 UNK 0.0621 44 H16 -2.0891 5.8358 -0.2262 H 1 UNK 0.0632 45 H17 -2.3338 5.7161 -4.4845 H 1 UNK 0.0632 46 H18 -2.9877 3.3447 -4.3792 H 1 UNK 0.0621 47 H19 -1.1522 -2.4889 -1.5824 H 1 UNK 0.1528 48 H20 -0.1438 -4.8785 1.9136 H 1 UNK 0.0729 49 H21 -2.6213 -4.9807 1.9287 H 1 UNK 0.0265 50 H22 -2.5726 -6.3316 0.7707 H 1 UNK 0.0265 51 H23 -1.9145 -6.5415 2.4111 H 1 UNK 0.0265 52 H24 1.1149 -6.2416 0.2686 H 1 UNK 0.0265 53 H25 0.2673 -7.2778 1.4417 H 1 UNK 0.0265 54 H26 -0.3908 -7.0679 -0.1988 H 1 UNK 0.0265 @BOND 1 1 2 1 2 1 29 1 3 1 30 1 4 1 31 1 5 2 3 1 6 2 4 1 7 2 32 1 8 3 33 1 9 3 34 1 10 3 35 1 11 4 5 1 12 4 6 1 13 4 22 1 14 6 7 2 15 6 8 am 16 8 9 1 17 8 36 1 18 9 10 1 19 9 15 1 20 9 37 1 21 10 11 1 22 10 38 1 23 10 39 1 24 11 12 2 25 11 13 1 26 13 14 1 27 14 40 1 28 14 41 1 29 14 42 1 30 15 20 ar 31 15 16 ar 32 16 17 ar 33 16 43 1 34 17 18 ar 35 17 44 1 36 18 19 ar 37 18 21 1 38 19 20 ar 39 19 45 1 40 20 46 1 41 22 23 am 42 22 47 1 43 23 24 2 44 23 25 1 45 25 26 1 46 26 27 1 47 26 28 1 48 26 48 1 49 27 49 1 50 27 50 1 51 27 51 1 52 28 52 1 53 28 53 1 54 28 54 1