@MOLECULE 1'-benzyl-4-(~125~i)iodo-3-phenyl-3,4'-bipiperidine-2,6-dione 28 31 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 I 3.5934 -0.5343 1.0937 I 1 UNL1 0.0950 2 O 1.9960 -0.3925 -2.5784 O.2 1 UNL1 -0.3889 3 O 0.3667 -3.9910 -2.7695 O.2 1 UNL1 -0.2438 4 N -3.1819 -0.2216 1.0233 N.pl3 1 UNL1 -0.3464 5 N 0.5835 -1.9088 -1.6225 N.am 1 UNL1 -0.6329 6 C -0.5577 0.1626 -0.1530 C.2 1 UNL1 0.1334 7 C 0.9248 0.2211 -0.4912 C.3 1 UNL1 0.0016 8 C -1.7448 0.4821 -0.7573 C.2 1 UNL1 -0.1226 9 C -0.7640 -0.3819 1.1567 C.2 1 UNL1 -0.3165 10 C 1.5592 -0.3534 0.7964 C.2 1 UNL1 -0.2301 11 C -2.8990 0.2980 -0.2132 C.2 1 UNL1 0.0807 12 C -2.0420 -0.5951 1.7874 C.3 1 UNL1 0.3178 13 C 1.3555 1.6171 -0.7464 C.ar 1 UNL1 -0.0499 14 C 1.2520 -0.6839 -1.6842 C.2 1 UNL1 0.6396 15 C 0.5466 -0.6463 1.6168 C.2 1 UNL1 0.1386 16 C -4.4183 -0.4181 1.6038 C.3 1 UNL1 0.3850 17 C 0.5625 -2.9400 -2.3119 C.1 1 UNL1 0.6450 18 C 1.7818 2.1182 -1.9767 C.ar 1 UNL1 0.0610 19 C 1.3951 2.6254 0.2174 C.ar 1 UNL1 0.0095 20 C -5.6089 -0.0919 0.8208 C.ar 1 UNL1 -0.2475 21 C 2.1721 3.3656 -2.1913 C.ar 1 UNL1 -0.0359 22 C 1.7836 3.8684 -0.0046 C.ar 1 UNL1 -0.0359 23 C 2.1817 4.2711 -1.2127 C.ar 1 UNL1 0.0517 24 C -6.8237 0.1941 1.4485 C.ar 1 UNL1 0.0886 25 C -5.7888 -0.0973 -0.5652 C.ar 1 UNL1 0.0455 26 C -7.9642 0.4325 0.8206 C.ar 1 UNL1 -0.0718 27 C -6.9347 0.1234 -1.1844 C.ar 1 UNL1 -0.0534 28 C -8.0526 0.3979 -0.5092 C.ar 1 UNL1 0.0828 @BOND 1 3 17 2 2 2 14 2 3 17 5 2 4 21 18 ar 5 21 23 ar 6 18 13 ar 7 14 5 1 8 14 7 1 9 23 22 ar 10 27 25 ar 11 27 28 ar 12 8 11 2 13 8 6 1 14 13 7 1 15 13 19 ar 16 25 20 ar 17 28 26 ar 18 7 6 1 19 7 10 1 20 11 4 1 21 6 9 2 22 22 19 ar 23 10 1 1 24 10 15 2 25 26 24 ar 26 20 24 ar 27 20 16 1 28 4 16 1 29 4 12 1 30 9 15 1 31 9 12 1