@MOLECULE (1s,8s,10s,12r)-4',4',11,11,14-pentamethyl-4'h,15h-spiro[3,14-diazatetracyclo[6.5.2.0~1,10~.0~3,8~]pentadecane-12,8'-[1,4]dioxepino[2,3-g]indole]-9',15(10'h)-dione 35 39 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 O 4.1469 0.8245 2.3558 O.2 1 GLY1 -0.1723 2 O 0.7287 3.8186 0.2796 O.2 1 UNL1 -0.1450 3 O -7.0638 2.2604 0.3359 O.2 1 UNL1 -0.2146 4 O -6.5414 -3.3326 -0.2060 O.2 1 UNL1 -0.2156 5 N 4.0509 -1.0601 -0.7913 N.pl3 1 UNL1 -0.4427 6 N 1.9347 -1.9658 2.8411 N.1 1 GLY1 -0.1150 7 N -2.7047 2.2896 0.0116 N.1 1 UNL1 -0.5207 8 C 1.6336 -0.8525 -0.6420 C.2 1 UNL1 -0.2243 9 C 3.0269 2.3878 -1.5157 C.2 1 UNL1 0.5729 10 C 0.5221 1.3975 -0.2960 C.2 1 UNL1 -0.2461 11 C -0.7645 0.7601 -0.2172 C.2 1 UNL1 -0.0219 12 C 0.3914 -1.5142 -0.4806 C.2 1 UNL1 -0.0227 13 C 4.1480 0.4034 -0.8015 C.2 1 UNL1 0.1512 14 CA 2.5636 -0.9958 2.7632 C.1 1 GLY1 0.0177 15 C 2.8183 -1.6939 -0.8286 C.2 1 UNL1 0.3454 16 C 2.9351 1.1743 -0.9515 C.2 1 UNL1 -0.5888 17 C 5.4073 0.8742 -0.7247 C.2 1 UNL1 -0.1624 18 C 3.2337 0.2296 2.7507 C.2 1 GLY1 0.2693 19 C 0.6423 2.6979 0.0168 C.1 1 UNL1 0.3954 20 C -0.6928 -0.6163 -0.3026 C.2 1 UNL1 -0.0459 21 C -3.2146 3.3614 0.0759 C.1 1 UNL1 0.3459 22 C 5.1487 -1.9463 -0.7278 C.3 1 UNL1 0.3364 23 C 6.4588 0.0585 -0.6451 C.2 1 UNL1 0.0605 24 C 6.3825 -1.2250 -0.6487 C.2 1 UNL1 -0.2036 25 C 1.6671 0.5448 -0.6129 C.3 1 UNL1 0.1420 26 C -2.1641 1.0523 -0.0788 C.2 1 UNL1 0.1951 27 C -0.2880 -2.7509 -0.4679 C.2 1 UNL1 0.0866 28 C -2.9623 -0.2055 -0.0849 C.2 1 UNL1 -0.0482 29 C -1.6540 -2.6044 -0.3200 C.2 1 UNL1 0.0014 30 C -2.0400 -1.2977 -0.2132 C.2 1 UNL1 -0.0427 31 C -4.3018 -0.2982 -0.0177 C.3 1 UNL1 0.1899 32 C -6.3706 1.3396 0.2197 C.1 1 UNL1 0.5114 33 C -5.5862 0.3094 0.0886 C.2 1 UNL1 -0.3607 34 C -5.4576 -1.1301 -0.0373 C.2 1 UNL1 -0.3550 35 C -6.0341 -2.2946 -0.1268 C.1 1 UNL1 0.5270 @BOND 1 9 16 2 2 16 13 1 3 16 25 1 4 15 5 1 5 15 8 2 6 13 5 1 7 13 17 2 8 5 22 1 9 22 24 1 10 17 23 1 11 24 23 2 12 8 25 1 13 8 12 1 14 25 10 1 15 12 27 2 16 12 20 1 17 27 29 1 18 29 30 2 19 20 11 2 20 20 30 1 21 10 11 1 22 10 19 2 23 11 26 1 24 30 28 1 25 4 35 2 26 35 34 2 27 28 26 2 28 28 31 1 29 26 7 1 30 34 31 1 31 34 33 1 32 31 33 1 33 7 21 3 34 19 2 2 35 33 32 2 36 32 3 2 37 1 18 2 38 18 14 1 39 14 6 3