0 mol 7 unq 0 iso 0 dist 9.90117 6.96396 7.21217 11.1727 5.07985 6.1206 15.2825 13.2513 13.2247 9.87885 numMergedOcc 0
1 mol 16 unq 0 iso 0 dist 7.88676 5.66097 5.84479 12.8674 6.04677 8.43054 12.558 9.18436 6.92781 6.57331 numMergedOcc 0
2 mol 109 unq 0 iso 0 dist 8.59182 12.4009 8.21889 18.3991 14.5244 7.86666 25.4872 22.3783 17.2949 9.77497 numMergedOcc 0
3 mol 119 unq 0 iso 0 dist 8.24549 4.99061 6.49205 10.7143 8.22696 8.95212 14.536 12.6552 10.9871 6.99446 numMergedOcc 0
4 mol 119 unq 1 iso 0 dist 8.24549 4.99061 6.49205 10.7143 8.22696 8.95212 14.2612 10.0583 9.93257 7.64052 numMergedOcc 0
5 mol 152 unq 0 iso 0 dist 5.59682 6.62991 8.89982 9.17216 9.0696 6.59889 13.4463 14.5119 7.65448 6.70693 numMergedOcc 0
6 mol 152 unq 1 iso 0 dist 7.71277 7.17016 8.89982 9.40483 9.0696 6.59889 11.3742 14.5119 7.65448 6.70693 numMergedOcc 0
7 mol 181 unq 0 iso 0 dist 6.47689 4.681 6.43406 8.39573 5.71744 5.05973 12.5935 11.5992 11.5866 9.01624 numMergedOcc 0
8 mol 224 unq 0 iso 0 dist 7.47122 15.4433 9.75313 8.57781 3.56689 8.08349 10.8616 11.1179 10.3613 9.78218 numMergedOcc 0
9 mol 224 unq 1 iso 0 dist 5.97988 6.70321 6.08709 14.4359 11.4272 8.08349 16.2012 15.5817 10.3613 9.78218 numMergedOcc 0
10 mol 224 unq 2 iso 0 dist 6.6537 4.55824 9.75313 5.36326 3.56689 8.08349 6.91193 11.1179 10.3613 9.78218 numMergedOcc 0
11 mol 224 unq 3 iso 0 dist 9.08719 4.55824 6.08709 5.36326 11.4272 8.08349 6.91193 15.5817 10.3613 9.78218 numMergedOcc 0
12 mol 235 unq 0 iso 0 dist 7.99218 10.3775 7.2346 10.2111 5.39025 5.1823 16.7448 10.5214 7.218 8.19317 numMergedOcc 0
13 mol 235 unq 1 iso 0 dist 7.99218 10.3775 7.2346 11.57 4.3433 5.70635 16.7448 10.5214 7.218 6.29377 numMergedOcc 0
14 mol 238 unq 0 iso 0 dist 5.57184 7.01206 5.24313 9.67281 12.4194 9.12776 11.2453 16.0821 15.7907 9.72188 numMergedOcc 0
15 mol 238 unq 1 iso 0 dist 6.74214 6.3873 9.31417 14.5078 13.338 9.72188 20.5516 21.1413 15.7907 9.12776 numMergedOcc 0
16 mol 238 unq 2 iso 0 dist 5.33462 6.3873 5.56719 14.5078 12.046 9.72188 20.5516 19.8325 15.7907 9.12776 numMergedOcc 0
17 mol 259 unq 0 iso 0 dist 8.73077 13.6207 6.77279 18.4793 9.90573 9.07743 16.6797 9.58006 4.69778 7.66153 numMergedOcc 0
18 mol 259 unq 1 iso 0 dist 8.73077 16.6797 9.58006 18.4793 9.90573 7.66153 13.6207 6.77279 4.69778 9.07743 numMergedOcc 0
19 mol 259 unq 2 iso 0 dist 6.76656 10.908 6.77279 15.148 9.90573 9.07743 12.7595 9.58006 4.69778 7.66153 numMergedOcc 0
20 mol 259 unq 3 iso 0 dist 6.76656 12.7595 9.58006 15.148 9.90573 7.66153 10.908 6.77279 4.69778 9.07743 numMergedOcc 0
21 mol 259 unq 4 iso 0 dist 9.45077 8.63445 7.93997 13.113 7.06301 5.85442 15.3022 9.52383 9.98105 6.9899 numMergedOcc 0
22 mol 259 unq 5 iso 0 dist 9.45077 8.63445 7.93997 13.7343 7.80863 6.95511 12.9305 13.8509 6.96053 9.46361 numMergedOcc 0
23 mol 259 unq 6 iso 0 dist 4.55368 6.18571 7.93997 8.40328 7.06301 5.85442 12.3834 9.52383 9.98105 6.9899 numMergedOcc 0
24 mol 259 unq 7 iso 0 dist 4.55368 6.18571 7.93997 8.2518 7.80863 6.95511 11.0067 13.8509 6.96053 9.46361 numMergedOcc 0
25 mol 277 unq 0 iso 0 dist 6.23539 6.16829 9.02914 11.2458 13.3706 5.46926 11.6142 10.9325 7.69449 9.57499 numMergedOcc 0
26 mol 277 unq 1 iso 0 dist 6.23539 6.16829 9.02914 11.2458 13.3706 5.46926 7.44724 6.90434 7.08227 8.9682 numMergedOcc 0
27 mol 277 unq 2 iso 0 dist 6.23539 6.16829 9.02914 9.4543 12.1739 5.13913 7.44724 6.90434 7.08227 6.92711 numMergedOcc 0
28 mol 277 unq 3 iso 0 dist 6.23539 7.44724 6.90434 11.2458 13.3706 8.9682 11.6142 10.9325 11.8268 9.57499 numMergedOcc 0
29 mol 277 unq 4 iso 0 dist 6.23539 7.44724 6.90434 11.2458 13.3706 8.9682 6.16829 9.02914 7.08227 5.46926 numMergedOcc 0
30 mol 277 unq 5 iso 0 dist 6.23539 7.44724 6.90434 9.4543 12.1739 6.92711 6.16829 9.02914 7.08227 5.13913 numMergedOcc 0
31 mol 280 unq 0 iso 0 dist 7.3304 7.26698 8.85762 11.3818 7.42656 6.86234 12.0417 11.1402 5.51836 6.02353 numMergedOcc 0
