@MOLECULE FDBD02304 56 58 0 0 0 SMALL USER_CHARGES @ATOM 1 C -4.0226 -2.9300 4.9119 C.3 1 UNK -0.0307 2 C1 -3.6033 -4.2632 4.2893 C.3 1 UNK 0.0868 3 O -2.7601 -4.0182 3.1619 O.3 1 UNK -0.4922 4 C2 -2.2966 -5.1049 2.4902 C.ar 1 UNK 0.1205 5 C3 -2.6509 -6.3808 2.9042 C.ar 1 UNK -0.0197 6 C4 -2.1789 -7.4838 2.2195 C.ar 1 UNK -0.0545 7 C5 -1.3536 -7.3171 1.1227 C.ar 1 UNK -0.0393 8 C6 -0.9987 -6.0467 0.7084 C.ar 1 UNK -0.0545 9 C7 -1.4731 -4.9402 1.3860 C.ar 1 UNK -0.0197 10 C8 -0.8398 -8.5222 0.3779 C.3 1 UNK 0.0135 11 C9 -0.0206 -9.3979 1.3282 C.3 1 UNK -0.0537 12 C10 -2.0214 -9.3274 -0.1665 C.3 1 UNK -0.0537 13 C11 0.0444 -8.0649 -0.7840 C.3 1 UNK 0.0572 14 O1 0.5317 -9.2076 -1.4902 O.3 1 UNK -0.3743 15 C12 1.3726 -8.8894 -2.6009 C.3 1 UNK 0.0728 16 C13 1.8263 -10.1621 -3.2683 C.ar 1 UNK -0.0185 17 C14 2.9907 -10.7825 -2.8537 C.ar 1 UNK -0.0562 18 C15 3.4095 -11.9504 -3.4635 C.ar 1 UNK -0.0580 19 C16 2.6655 -12.5006 -4.4895 C.ar 1 UNK -0.0193 20 C17 1.4971 -11.8802 -4.9073 C.ar 1 UNK 0.1288 21 C18 1.0759 -10.7110 -4.2896 C.ar 1 UNK -0.0140 22 O2 0.7636 -12.4192 -5.9163 O.3 1 UNK -0.4560 23 C19 -0.3132 -11.7223 -6.3649 C.ar 1 UNK 0.1284 24 C20 -0.1630 -10.7892 -7.3808 C.ar 1 UNK -0.0193 25 C21 -1.2593 -10.0820 -7.8351 C.ar 1 UNK -0.0583 26 C22 -2.5054 -10.3031 -7.2781 C.ar 1 UNK -0.0615 27 C23 -2.6577 -11.2321 -6.2653 C.ar 1 UNK -0.0583 28 C24 -1.5659 -11.9467 -5.8120 C.ar 1 UNK -0.0193 29 H -4.6540 -3.1135 5.7561 H 1 UNK 0.0262 30 H1 -4.5552 -2.3499 4.1875 H 1 UNK 0.0262 31 H2 -3.1518 -2.3942 5.2275 H 1 UNK 0.0262 32 H3 -4.4741 -4.7990 3.9737 H 1 UNK 0.0694 33 H4 -3.0707 -4.8433 5.0137 H 1 UNK 0.0694 34 H5 -3.2665 -6.5057 3.7230 H 1 UNK 0.0654 35 H6 -2.4425 -8.4331 2.5268 H 1 UNK 0.0622 36 H7 -0.3789 -5.9249 -0.1077 H 1 UNK 0.0622 37 H8 -1.2151 -3.9919 1.0710 H 1 UNK 0.0654 38 H9 -0.6389 -9.7177 2.1408 H 1 UNK 0.0239 39 H10 0.8057 -8.8348 1.7090 H 1 UNK 0.0239 40 H11 0.3443 -10.2536 0.7994 H 1 UNK 0.0239 41 H12 -2.6397 -9.6472 0.6461 H 1 UNK 0.0239 42 H13 -1.6565 -10.1831 -0.6952 H 1 UNK 0.0239 43 H14 -2.5943 -8.7151 -0.8311 H 1 UNK 0.0239 44 H15 0.8707 -7.5018 -0.4032 H 1 UNK 0.0568 45 H16 -0.5285 -7.4525 -1.4486 H 1 UNK 0.0568 46 H17 2.2260 -8.3431 -2.2572 H 1 UNK 0.0610 47 H18 0.8267 -8.2938 -3.3024 H 1 UNK 0.0610 48 H19 3.5480 -10.3729 -2.0877 H 1 UNK 0.0621 49 H20 4.2786 -12.4116 -3.1521 H 1 UNK 0.0619 50 H21 2.9786 -13.3723 -4.9446 H 1 UNK 0.0654 51 H22 0.2028 -10.2521 -4.5931 H 1 UNK 0.0658 52 H23 0.7669 -10.6237 -7.7966 H 1 UNK 0.0654 53 H24 -1.1482 -9.3881 -8.5908 H 1 UNK 0.0619 54 H25 -3.3232 -9.7738 -7.6189 H 1 UNK 0.0618 55 H26 -3.5878 -11.3917 -5.8477 H 1 UNK 0.0619 56 H27 -1.6818 -12.6469 -5.0628 H 1 UNK 0.0654 @BOND 1 1 2 1 2 2 3 1 3 3 4 1 4 4 9 ar 5 4 5 ar 6 5 6 ar 7 6 7 ar 8 7 8 ar 9 7 10 1 10 8 9 ar 11 10 11 1 12 10 12 1 13 10 13 1 14 13 14 1 15 14 15 1 16 15 16 1 17 16 21 ar 18 16 17 ar 19 17 18 ar 20 18 19 ar 21 19 20 ar 22 20 21 ar 23 20 22 1 24 22 23 1 25 23 28 ar 26 23 24 ar 27 24 25 ar 28 25 26 ar 29 26 27 ar 30 27 28 ar 31 1 29 1 32 1 30 1 33 1 31 1 34 2 32 1 35 2 33 1 36 5 34 1 37 6 35 1 38 8 36 1 39 9 37 1 40 11 38 1 41 11 39 1 42 11 40 1 43 12 41 1 44 12 42 1 45 12 43 1 46 13 44 1 47 13 45 1 48 15 46 1 49 15 47 1 50 17 48 1 51 18 49 1 52 19 50 1 53 21 51 1 54 24 52 1 55 25 53 1 56 26 54 1 57 27 55 1 58 28 56 1