@MOLECULE n-(3-biphenylyl)-2-iodobenzamide 36 38 0 0 0 SMALL USER_CHARGES @ATOM 1 I -2.8985 1.4527 -0.3646 I 1 UNL111111 0.0239 2 N 0.0359 -0.6640 0.3601 N.am 1 UNL111111 -0.5670 3 O -1.1774 -0.8610 2.2930 O.2 1 UNL111111 -0.4600 4 C -3.1202 -0.6512 -0.4231 C.ar 1 UNL111111 -0.0416 5 C -2.2307 -1.4823 0.2515 C.ar 1 UNL111111 -0.1465 6 C -2.3950 -2.8672 0.1973 C.ar 1 UNL111111 -0.0987 7 C -3.4412 -3.4141 -0.5407 C.ar 1 UNL111111 -0.1514 8 C -4.3295 -2.5761 -1.2125 C.ar 1 UNL111111 -0.1126 9 C -4.1764 -1.1915 -1.1536 C.ar 1 UNL111111 -0.1642 10 C -1.1060 -0.9689 1.0933 C.2 1 UNL111111 0.5780 11 C 1.2527 -0.2076 0.9204 C.ar 1 UNL111111 0.2318 12 C 2.4019 -0.3210 0.1194 C.ar 1 UNL111111 -0.2608 13 C 3.6261 0.1145 0.6180 C.ar 1 UNL111111 0.0321 14 C 3.7174 0.6603 1.9002 C.ar 1 UNL111111 -0.2038 15 C 2.5700 0.7778 2.6803 C.ar 1 UNL111111 -0.0944 16 C 1.3346 0.3516 2.2014 C.ar 1 UNL111111 -0.2126 17 C 4.8301 -0.0044 -0.2173 C.ar 1 UNL111111 -0.0215 18 C 5.1995 1.0477 -1.0573 C.ar 1 UNL111111 -0.1514 19 C 6.3386 0.9314 -1.8505 C.ar 1 UNL111111 -0.1423 20 C 7.1060 -0.2314 -1.8048 C.ar 1 UNL111111 -0.1533 21 C 6.7357 -1.2801 -0.9644 C.ar 1 UNL111111 -0.1422 22 C 5.5979 -1.1691 -0.1684 C.ar 1 UNL111111 -0.1511 23 H 0.0296 -0.8168 -0.6443 H 1 UNL111111 0.3189 24 H -1.7062 -3.5185 0.7400 H 1 UNL111111 0.1705 25 H -3.5679 -4.4952 -0.5886 H 1 UNL111111 0.1624 26 H -5.1527 -3.0038 -1.7856 H 1 UNL111111 0.1580 27 H -4.8899 -0.5571 -1.6810 H 1 UNL111111 0.1684 28 H 2.3471 -0.7482 -0.8783 H 1 UNL111111 0.1632 29 H 4.6798 0.9916 2.2818 H 1 UNL111111 0.1604 30 H 2.6374 1.2096 3.6792 H 1 UNL111111 0.1526 31 H 0.4456 0.4562 2.8259 H 1 UNL111111 0.1935 32 H 4.5964 1.9531 -1.0898 H 1 UNL111111 0.1575 33 H 6.6290 1.7497 -2.5062 H 1 UNL111111 0.1490 34 H 7.9953 -0.3200 -2.4249 H 1 UNL111111 0.1478 35 H 7.3357 -2.1870 -0.9290 H 1 UNL111111 0.1490 36 H 5.3046 -1.9849 0.4909 H 1 UNL111111 0.1580 @BOND 1 33 19 1 2 34 20 1 3 19 20 ar 4 19 18 ar 5 20 21 ar 6 26 8 1 7 27 9 1 8 8 9 ar 9 8 7 ar 10 9 4 ar 11 32 18 1 12 18 17 ar 13 21 35 1 14 21 22 ar 15 28 12 1 16 23 2 1 17 25 7 1 18 7 6 ar 19 4 1 1 20 4 5 ar 21 17 22 ar 22 17 13 1 23 22 36 1 24 12 13 ar 25 12 11 ar 26 6 5 ar 27 6 24 1 28 5 10 1 29 2 11 1 30 2 10 am 31 13 14 ar 32 11 16 ar 33 10 3 2 34 14 29 1 35 14 15 ar 36 16 15 ar 37 16 31 1 38 15 30 1