@MOLECULE FDBD03071 40 42 0 0 0 SMALL USER_CHARGES @ATOM 1 C -0.4111 1.4205 -0.2764 C.3 1 UNK -0.0652 2 C1 -0.2860 -0.1021 -0.1939 C.3 1 UNK -0.0535 3 C2 0.3620 -0.6308 -1.4751 C.3 1 UNK -0.0246 4 C3 0.4871 -2.1534 -1.3925 C.3 1 UNK 0.0859 5 C4 1.1679 -2.7236 -2.6619 C.3 1 UNK 0.0778 6 O 1.7667 -3.9472 -2.1892 O.3 1 UNK -0.3374 7 C5 1.9107 -3.8297 -0.7676 C.3 1 UNK 0.2623 8 C6 1.1023 -4.9296 -0.0765 C.3 1 UNK 0.2355 9 N 1.5456 -6.2392 -0.5610 N.ar 1 UNK -0.0657 10 C7 1.9555 -7.2784 0.1868 C.ar 1 UNK 0.2727 11 N1 2.2647 -8.2615 -0.6192 N.ar 1 UNK -0.2928 12 C8 2.0662 -7.8893 -1.8831 C.ar 1 UNK 0.1651 13 N2 1.6210 -6.6604 -1.8986 N.ar 1 UNK 0.0139 14 C9 3.3648 -3.9592 -0.3936 C.ar 1 UNK 0.0360 15 C10 3.7581 -4.9054 0.5344 C.ar 1 UNK -0.0505 16 C11 5.0913 -5.0247 0.8779 C.ar 1 UNK -0.0429 17 C12 6.0336 -4.1973 0.2927 C.ar 1 UNK 0.0424 18 C13 5.6408 -3.2508 -0.6361 C.ar 1 UNK -0.0246 19 C14 4.3065 -3.1350 -0.9832 C.ar 1 UNK 0.0508 20 Cl 3.8125 -1.9473 -2.1489 Cl 1 UNK -0.0830 21 Cl1 7.7083 -4.3469 0.7247 Cl 1 UNK -0.0835 22 O1 1.4224 -2.5414 -0.3576 O.3 1 UNK -0.3344 23 H -0.8643 1.7902 0.6196 H 1 UNK 0.0230 24 H1 -1.0178 1.6835 -1.1177 H 1 UNK 0.0230 25 H2 0.5613 1.8527 -0.3889 H 1 UNK 0.0230 26 H3 -1.2584 -0.5343 -0.0814 H 1 UNK 0.0263 27 H4 0.3207 -0.3650 0.6474 H 1 UNK 0.0263 28 H5 1.3343 -0.1986 -1.5876 H 1 UNK 0.0291 29 H6 -0.2447 -0.3679 -2.3164 H 1 UNK 0.0291 30 H7 -0.5094 -2.5100 -1.2350 H 1 UNK 0.0620 31 H8 1.9118 -2.0506 -3.0342 H 1 UNK 0.0587 32 H9 0.4868 -2.8743 -3.4732 H 1 UNK 0.0587 33 H10 0.0633 -4.8007 -0.2971 H 1 UNK 0.1115 34 H11 1.2522 -4.8712 0.9813 H 1 UNK 0.1115 35 H12 2.0158 -7.2974 1.2169 H 1 UNK 0.1623 36 H13 2.5947 -9.1443 -0.3344 H 1 UNK 0.1720 37 H14 2.2363 -8.4761 -2.7148 H 1 UNK 0.1090 38 H15 3.0558 -5.5229 0.9708 H 1 UNK 0.0623 39 H16 5.3843 -5.7310 1.5710 H 1 UNK 0.0632 40 H17 6.3427 -2.6311 -1.0701 H 1 UNK 0.0647 @BOND 1 1 2 1 2 2 3 1 3 3 4 1 4 4 22 1 5 4 5 1 6 5 6 1 7 6 7 1 8 7 8 1 9 7 14 1 10 7 22 1 11 8 9 1 12 9 13 ar 13 9 10 ar 14 10 11 ar 15 11 12 ar 16 12 13 ar 17 14 19 ar 18 14 15 ar 19 15 16 ar 20 16 17 ar 21 17 18 ar 22 17 21 1 23 18 19 ar 24 19 20 1 25 1 23 1 26 1 24 1 27 1 25 1 28 2 26 1 29 2 27 1 30 3 28 1 31 3 29 1 32 4 30 1 33 5 31 1 34 5 32 1 35 8 33 1 36 8 34 1 37 10 35 1 38 11 36 1 39 12 37 1 40 15 38 1 41 16 39 1 42 18 40 1