0 mol 27 unq 0 iso 0 dist 9.48375 9.62305 15.4799 14.5373 20.7923 6.78936 numMergedOcc 0
1 mol 27 unq 1 iso 0 dist 6.85127 9.62305 14.1714 14.5373 20.166 6.78936 numMergedOcc 0
2 mol 27 unq 2 iso 0 dist 8.58169 9.62305 12.3417 14.5373 18.4376 6.78936 numMergedOcc 0
3 mol 53 unq 0 iso 0 dist 7.57227 7.61429 4.94089 5.01743 8.79235 7.58093 numMergedOcc 0
4 mol 61 unq 0 iso 0 dist 5.97418 6.96665 12.1181 10.8066 15.9511 9.92638 numMergedOcc 0
5 mol 67 unq 0 iso 0 dist 6.57749 8.57393 12.2982 11.5706 10.4907 8.96498 numMergedOcc 0
6 mol 67 unq 1 iso 0 dist 6.57749 8.57393 12.2982 10.8492 16.8736 7.5228 numMergedOcc 0
7 mol 95 unq 0 iso 0 dist 9.07757 6.65315 5.26193 6.43646 10.3127 9.51318 numMergedOcc 0
8 mol 95 unq 1 iso 0 dist 9.07757 6.65315 5.26193 5.80449 9.11547 9.84457 numMergedOcc 0
9 mol 115 unq 0 iso 0 dist 7.82151 6.41059 5.80806 6.05927 12.3382 8.0168 numMergedOcc 0
10 mol 119 unq 0 iso 0 dist 8.54701 8.15125 10.7175 11.3005 16.2836 6.13374 numMergedOcc 0
11 mol 143 unq 0 iso 0 dist 9.76501 4.86894 5.70415 7.21648 10.4827 8.18023 numMergedOcc 0
12 mol 143 unq 1 iso 0 dist 9.76501 4.86894 5.70415 9.42107 11.3526 7.46803 numMergedOcc 0
13 mol 148 unq 0 iso 0 dist 8.80448 6.3102 10.3367 8.93277 16.3837 8.42899 numMergedOcc 0
14 mol 150 unq 0 iso 0 dist 8.78855 6.25629 10.2679 8.91488 16.3471 8.33721 numMergedOcc 0
15 mol 157 unq 0 iso 0 dist 6.66184 9.63472 12.5837 5.61367 10.9016 6.4431 numMergedOcc 0
16 mol 168 unq 0 iso 0 dist 9.58783 6.80155 14.1838 9.96378 14.4126 7.06851 numMergedOcc 0
17 mol 238 unq 0 iso 0 dist 7.00773 6.54661 5.32456 6.13838 8.31815 9.38131 numMergedOcc 0
18 mol 238 unq 1 iso 0 dist 7.00773 8.97261 6.26991 6.13838 8.31815 6.85253 numMergedOcc 0
19 mol 260 unq 0 iso 0 dist 9.94532 6.57783 8.59973 5.97248 14.9683 8.5613 numMergedOcc 0
20 mol 260 unq 1 iso 0 dist 9.94532 6.18853 11.1345 5.97248 14.9683 5.7791 numMergedOcc 0
21 mol 272 unq 0 iso 0 dist 6.36458 6.1535 6.43195 9.12506 14.2347 9.19905 numMergedOcc 0
22 mol 283 unq 0 iso 0 dist 6.89455 6.87568 4.90822 7.95433 12.9982 9.60574 numMergedOcc 0
23 mol 283 unq 1 iso 0 dist 8.821 6.87568 10.7319 7.95433 13.3092 9.60574 numMergedOcc 0
24 mol 283 unq 2 iso 0 dist 9.82337 6.87568 7.05375 7.95433 12.3541 9.60574 numMergedOcc 0
25 mol 283 unq 3 iso 0 dist 8.07626 6.50648 4.90822 7.04425 12.9982 9.60574 numMergedOcc 0
26 mol 283 unq 4 iso 0 dist 6.3448 6.50648 7.05375 7.04425 12.3541 9.60574 numMergedOcc 0
