166
squid_pq (C86H74N2O4); converted from 1_PQ2+_CAMacetone.hin
C  -5.907614  4.326889  1.316972
C  -4.538670  4.529808  1.291342
C  -3.803402  4.322386  0.120241
C  -4.507328  4.060231 -1.056533
C  -5.875914  3.833085 -1.025109
C  -6.587248  3.875603  0.179698
C  -7.868355  3.136445  0.279669
C  -8.070910  2.349698  1.417355
C  -8.831853  1.196376  1.352561
C  -9.410600  0.789976  0.145645
C  -9.457593  1.733401 -0.889576
C  -8.690839  2.887193 -0.825999
H  -8.652863  3.544298 -1.688823
H  -9.994014  1.506937 -1.805183
C  -9.437169 -0.673667 -0.109777
C  -9.485923 -1.617106  0.925701
C  -8.755573 -2.792950  0.841422
C  -7.968928 -3.064422 -0.285373
C  -8.180260 -2.271394 -1.417171
C  -8.905653 -1.097048 -1.332206
H  -8.890804 -0.418458 -2.176903
H  -7.633914 -2.472258 -2.330945
C  -6.702011 -3.831556 -0.215930
C  -6.041191 -4.262251 -1.372510
C  -4.673925 -4.477542 -1.371130
C  -3.923961 -4.315149 -0.203173
C  -4.612011 -4.088499  0.990549
C  -5.977284 -3.839451  0.982225
H  -6.466651 -3.547193  1.904915
H  -4.061576 -4.023307  1.925439
C  -2.451963 -4.184762 -0.259953
C  -1.589950 -4.761846  0.676744
C  -0.226416 -4.495351  0.645625
C   0.324678 -3.635283 -0.311945
C  -0.539509 -3.076391 -1.258564
C  -1.896772 -3.348384 -1.235092
H  -2.550692 -2.882255 -1.964906
H  -0.148762 -2.400611 -2.011321
C   1.767857 -3.307835 -0.319132
C   2.428790 -2.978495 -1.501536
C   3.785808 -2.673065 -1.524948
C   4.507889 -2.734165 -0.326042
C   3.852122 -2.955020  0.891246
C   2.493258 -3.251489  0.871119
H   1.990847 -3.434736  1.816768
C   4.562525 -2.799164  2.221473
C   4.068533 -1.570409  2.959100
C   3.147588 -1.667414  4.003834
C   2.648996 -0.524623  4.623346
C   3.080900  0.733996  4.213819
C   4.012218  0.868459  3.186020
C   4.485696 -0.293778  2.562118
O   5.304638 -0.152248  1.483864
C   6.738397 -0.275955  1.647663
C   7.228632 -0.285570  3.080704
H   8.319520 -0.352411  3.067075
H   6.851701 -1.139408  3.648090
H   6.958282  0.624784  3.620530
H   7.032065 -1.188626  1.129003
H   7.145613  0.574670  1.105610
C   4.516903  2.225085  2.733390
C   3.890380  2.668684  1.428043
C   2.548953  3.024824  1.404215
C   1.895935  3.367787  0.220756
C   2.624040  3.289300 -0.966183
C   3.975901  2.951668 -0.985854
C   4.619957  2.702266  0.230255
O   5.979026  2.519303  0.259234
C   6.684356  3.753750  0.475462
C   8.160340  3.459488  0.588389
H   8.707118  4.383224  0.790440
H   8.356958  2.761570  1.405973
H   8.549405  3.031272 -0.337382
H   6.307884  4.226796  1.390654
H   6.477599  4.436564 -0.357709
C   4.691542  2.772488 -2.313360
C   4.139717  1.563109 -3.043749
C   3.104414  1.687169 -3.971540
C   2.517277  0.561172 -4.539928
C   2.946683 -0.708145 -4.167541
C   3.993359 -0.872497 -3.261024
C   4.596015  0.275691 -2.730964
O   5.659984  0.138844 -1.878815
C   6.911912  0.148908 -2.584731
C   8.038284  0.107019 -1.586314
H   7.988800  0.975872 -0.930860
H   8.998724  0.109797 -2.107316
H   7.969637 -0.793099 -0.976904
H   6.966270  1.052482 -3.204107
H   6.949480 -0.711623 -3.264185
C   4.446157 -2.253232 -2.823534
H   5.525757 -2.268093 -2.688955
H   4.194371 -2.971495 -3.608089
H   2.485671 -1.585208 -4.611360
H   1.734260  0.672508 -5.282430
H   2.767453  2.678106 -4.260969
H   5.756951  2.654018 -2.126231
H   4.551540  3.661820 -2.933398
H   2.126750  3.477716 -1.912249
C   0.453646  3.698256  0.215214
C  -0.392276  3.195133  1.208533
C  -1.752488  3.444934  1.185384
C  -2.331090  4.201713  0.161263
C  -1.488878  4.722359 -0.822733
C  -0.122729  4.482227 -0.789628
H   0.509752  4.932680 -1.546389
H  -1.905208  5.342887 -1.609448
H  -2.391460  3.027312  1.957140
H   0.019472  2.584049  2.005190
H   2.013545  3.057996  2.347234
H   5.599005  2.188018  2.614489
H   4.293589  2.958883  3.512299
H   2.714959  1.621882  4.720333
H   1.952644 -0.615671  5.450105
H   2.834158 -2.649572  4.345143
H   5.636230 -2.731763  2.051718
H   4.382552 -3.680776  2.842251
O   5.872315 -2.603910 -0.351565
C   6.535374 -3.875824 -0.461240
C   8.024235 -3.642471 -0.539081
H   8.545955 -4.600033 -0.601373
H   8.282036 -3.055071 -1.422636
H   8.386003 -3.115779  0.347311
H   6.169709 -4.394014 -1.355926
H   6.275684 -4.493431  0.407392
H   1.887336 -2.991296 -2.441537
H   0.425014 -4.989121  1.358245
H  -1.987554 -5.444068  1.421085
H  -4.170966 -4.737587 -2.296652
H  -6.589360 -4.359359 -2.302856
H  -8.716486 -3.451972  1.702747
H  -9.991546 -1.376210  1.855040
H  -8.816125  0.517659  2.197255
H  -7.494863  2.538319  2.315682
H  -6.379828  3.515036 -1.931458
H  -3.965908  3.945113 -1.991136
H  -4.022968  4.819989  2.200782
H  -6.444772  4.457193  2.250003
C  -1.993841  0.015492  0.027939
N  -2.684743 -0.626053  1.020126
C  -4.019797 -0.657751  1.035482
C  -4.765009 -0.009237  0.057413
C  -4.104688  0.622943 -0.972336
C  -2.694760  0.621257 -1.027019
C  -1.961651  1.171096 -2.124239
C  -0.610377  1.072618 -2.172552
C   0.124395  0.510236 -1.083093
C   1.537130  0.441303 -1.078221
C   2.206821  0.000712  0.036070
C   1.472768 -0.374826  1.154757
N   0.136278 -0.371097  1.136024
C  -0.566602  0.039670  0.035708
C  -0.629939 -0.680060  2.353675
C  -1.897706 -1.419711  1.988237
H  -2.505862 -1.579539  2.876930
H  -1.676297 -2.384103  1.523280
H  -0.009867 -1.293673  3.006286
H  -0.849372  0.262466  2.862995
H   1.940049 -0.681631  2.080771
H   3.289332 -0.044175  0.074534
H   2.079976  0.748657 -1.960295
H  -0.050634  1.442998 -3.023289
H  -2.514707  1.638062 -2.930187
H  -4.664543  1.121703 -1.754452
H  -5.847182 -0.032088  0.112920
H  -4.481698 -1.228194  1.830494
