@MOLECULE 1-(diisobutylnitroryl)-2-phenyl-2-phosphino-1-decanone 28 31 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 P -0.6989 0.3008 -2.0596 P.3 1 UNL1 -0.2434 2 C -0.7278 1.3838 -0.3304 C.3 1 UNL1 0.0909 3 C -0.9633 0.2620 0.6817 C.2 1 UNL1 0.3119 4 N -0.9617 -0.9660 0.2443 N.2 1 UNL1 -0.4667 5 O -1.3243 0.4602 1.9956 O.2 1 UNL1 -0.1888 6 C -0.9705 -1.1558 -1.1594 C.2 1 UNL1 0.2065 7 C -1.4390 -2.4672 -1.4539 C.2 1 UNL1 -0.1439 8 C -1.6745 -3.7624 -2.0915 C.3 1 UNL1 0.3684 9 C -2.2703 -3.3506 -0.8391 C.2 1 UNL1 -0.2988 10 C -3.1078 -3.5189 0.3467 C.2 1 UNL1 0.4870 11 C -2.6088 -1.5239 2.0208 C.1 1 UNL1 -0.2057 12 C -2.0972 -0.3454 2.6552 C.3 1 UNL1 0.4048 13 C -2.9091 -2.4817 1.3322 C.1 1 UNL1 -0.0492 14 C -1.8268 2.3093 -0.3846 C.3 1 UNL1 -0.1351 15 C -2.5133 3.3306 -0.3824 C.2 1 UNL1 0.0842 16 C -2.3057 4.6681 -0.1865 C.2 1 UNL1 -0.0504 17 C -1.2127 5.2253 0.0358 C.3 1 UNL1 0.0534 18 C 0.0221 4.6541 0.1561 C.2 1 UNL1 -0.0503 19 C 0.4723 3.5083 0.0920 C.1 1 UNL1 0.0175 20 C 0.5992 2.1183 -0.0550 C.2 1 UNL1 -0.1337 21 C 1.7515 1.4672 0.0269 C.1 1 UNL1 0.3014 22 C 2.8404 0.8278 0.0937 C.1 1 UNL1 -0.3667 23 C 3.9536 0.1796 0.1470 C.1 1 UNL1 0.4883 24 C 5.0519 -0.4569 0.1963 C.1 1 UNL1 -0.5182 25 C 6.1626 -1.1026 0.2395 C.1 1 UNL1 0.5945 26 C 7.2646 -1.7429 0.2797 C.1 1 UNL1 -0.7725 27 C 8.3808 -2.3930 0.3173 C.3 1 UNL1 0.5161 28 O -3.8920 -4.4256 0.4727 O.2 1 UNL1 -0.3018 @BOND 1 8 7 1 2 8 9 1 3 1 6 2 4 1 2 1 5 7 6 1 6 7 9 2 7 6 4 1 8 9 10 1 9 14 15 1 10 14 2 1 11 15 16 2 12 2 20 1 13 2 3 1 14 16 17 1 15 20 21 1 16 20 19 2 17 21 22 3 18 17 18 1 19 19 18 2 20 22 23 1 21 23 24 3 22 24 25 1 23 25 26 3 24 4 3 2 25 26 27 1 26 10 28 2 27 10 13 1 28 3 5 1 29 13 11 3 30 5 12 1 31 11 12 1