@MOLECULE FDBD03178 40 41 0 0 0 SMALL USER_CHARGES @ATOM 1 C -0.4701 1.5289 0.4110 C.3 1 UNK -0.0028 2 N -0.2573 0.2081 -0.1957 N.3 1 UNK -0.2174 3 C1 0.9511 -0.4303 0.3431 C.3 1 UNK -0.0028 4 P -1.6053 -0.7771 0.0161 P.3 1 UNK 0.3987 5 O -1.2156 -2.1929 -0.1683 O.2 1 UNK -0.2429 6 N1 -2.2192 -0.5618 1.5683 N.3 1 UNK -0.2174 7 C2 -3.4901 -1.2793 1.7360 C.3 1 UNK -0.0028 8 C3 -1.2420 -0.9775 2.5833 C.3 1 UNK -0.0028 9 N2 -2.7526 -0.3780 -1.0857 N.pl3 1 UNK 0.0337 10 C4 -3.6876 0.6360 -0.9832 C.cat 1 UNK 0.4477 11 N3 -3.8196 1.4627 0.0232 N.2 1 UNK -0.1217 12 N4 -4.4384 0.6232 -2.1022 N.pl3 1 UNK -0.1416 13 C5 -4.0361 -0.3354 -2.9049 C.cat 1 UNK 0.3127 14 C6 -4.6234 -0.6504 -4.2232 C.ar 1 UNK 0.0647 15 C7 -4.1108 -1.7015 -4.9863 C.ar 1 UNK -0.0469 16 C8 -4.6643 -1.9905 -6.2163 C.ar 1 UNK -0.0610 17 C9 -5.7251 -1.2416 -6.6943 C.ar 1 UNK -0.0617 18 C10 -6.2377 -0.1984 -5.9436 C.ar 1 UNK -0.0610 19 C11 -5.6975 0.0979 -4.7094 C.ar 1 UNK -0.0469 20 N5 -2.9814 -0.9929 -2.3283 N.2 1 UNK -0.1176 21 H 0.3998 2.1340 0.2624 H 1 UNK 0.0396 22 H1 -0.6504 1.4149 1.4595 H 1 UNK 0.0396 23 H2 -1.3147 1.9999 -0.0470 H 1 UNK 0.0396 24 H3 1.7915 0.2155 0.1959 H 1 UNK 0.0396 25 H4 1.1207 -1.3574 -0.1634 H 1 UNK 0.0396 26 H5 0.8213 -0.6139 1.3892 H 1 UNK 0.0396 27 H6 -4.1824 -0.9586 0.9859 H 1 UNK 0.0396 28 H7 -3.8923 -1.0705 2.7053 H 1 UNK 0.0396 29 H8 -3.3212 -2.3314 1.6390 H 1 UNK 0.0396 30 H9 -0.3275 -0.4411 2.4388 H 1 UNK 0.0396 31 H10 -1.0578 -2.0276 2.4921 H 1 UNK 0.0396 32 H11 -1.6289 -0.7667 3.5584 H 1 UNK 0.0396 33 H12 -3.2193 1.3920 0.8003 H 1 UNK 0.3068 34 H13 -5.1804 1.2422 -2.2906 H 1 UNK 0.3043 35 H14 -3.3197 -2.2608 -4.6309 H 1 UNK 0.0626 36 H15 -4.2864 -2.7670 -6.7813 H 1 UNK 0.0618 37 H16 -6.1359 -1.4621 -7.6150 H 1 UNK 0.0618 38 H17 -7.0260 0.3593 -6.3079 H 1 UNK 0.0618 39 H18 -6.0862 0.8707 -4.1467 H 1 UNK 0.0626 40 H19 -2.4808 -1.7496 -2.7105 H 1 UNK 0.3532 @BOND 1 1 2 1 2 2 3 1 3 2 4 1 4 4 5 2 5 4 6 1 6 4 9 1 7 6 7 1 8 6 8 1 9 9 20 1 10 9 10 1 11 10 11 2 12 10 12 1 13 12 13 1 14 13 14 1 15 13 20 2 16 14 19 ar 17 14 15 ar 18 15 16 ar 19 16 17 ar 20 17 18 ar 21 18 19 ar 22 1 21 1 23 1 22 1 24 1 23 1 25 3 24 1 26 3 25 1 27 3 26 1 28 7 27 1 29 7 28 1 30 7 29 1 31 8 30 1 32 8 31 1 33 8 32 1 34 11 33 1 35 12 34 1 36 15 35 1 37 16 36 1 38 17 37 1 39 18 38 1 40 19 39 1 41 20 40 1