0 mol 0 unq 0 iso 0 dist 6.94181 5.47921 7.15528 10.651 7.19817 9.6994 10.961 10.4498 9.23213 5.08793 numMergedOcc 0
1 mol 0 unq 1 iso 0 dist 6.94181 5.47921 7.15528 10.651 7.19817 9.6994 11.2375 5.52201 8.81979 5.63197 numMergedOcc 0
2 mol 43 unq 0 iso 0 dist 9.17086 5.90113 8.80331 10.615 8.13395 6.20293 14.2386 10.4442 9.83618 9.49077 numMergedOcc 0
3 mol 52 unq 0 iso 0 dist 7.70026 13.9113 7.34143 16.3413 9.162 9.80098 11.7979 4.5482 7.18176 5.93337 numMergedOcc 0
4 mol 54 unq 0 iso 0 dist 6.54183 5.65405 8.10861 14.4402 16.3192 9.5589 8.41365 10.1332 5.02241 6.91765 numMergedOcc 0
5 mol 54 unq 1 iso 0 dist 6.54183 5.65405 8.10861 10.5929 14.2075 6.83299 8.41365 10.1332 5.02241 5.06052 numMergedOcc 0
6 mol 72 unq 0 iso 0 dist 6.68311 15.0607 9.96708 10.1663 8.24309 9.78528 14.0266 9.0131 7.321 6.11922 numMergedOcc 0
7 mol 72 unq 1 iso 0 dist 6.7212 11.6369 9.96708 12.3223 10.7394 8.8178 11.9031 7.11552 6.77912 12.0644 numMergedOcc 0
8 mol 75 unq 0 iso 0 dist 8.2147 13.5815 7.79912 13.0332 5.64643 8.56639 15.5568 10.0425 5.15851 11.8774 numMergedOcc 0
9 mol 75 unq 1 iso 0 dist 8.2147 13.5815 7.79912 18.603 10.4899 8.59017 15.5568 10.0425 5.15851 10.0372 numMergedOcc 0
10 mol 100 unq 0 iso 0 dist 8.92577 12.0555 7.47343 15.3021 8.8807 6.65086 18.5548 15.209 7.75343 10.9608 numMergedOcc 0
11 mol 100 unq 1 iso 0 dist 8.92577 12.0555 7.47343 18.6091 12.6515 6.56369 18.5548 15.209 7.75343 5.69137 numMergedOcc 0
12 mol 100 unq 2 iso 0 dist 8.92577 12.0555 7.47343 19.8697 13.887 9.30209 18.5548 15.209 7.75343 9.21622 numMergedOcc 0
13 mol 100 unq 3 iso 0 dist 9.56324 16.8752 7.47343 17.1897 8.8807 6.65086 24.5025 15.209 7.75343 10.9608 numMergedOcc 0
14 mol 100 unq 4 iso 0 dist 9.56324 16.8752 7.47343 21.2171 12.6515 6.56369 24.5025 15.209 7.75343 5.69137 numMergedOcc 0
15 mol 100 unq 5 iso 0 dist 9.56324 16.8752 7.47343 22.2677 13.887 9.30209 24.5025 15.209 7.75343 9.21622 numMergedOcc 0
16 mol 100 unq 6 iso 0 dist 8.96916 5.92158 6.45675 5.70279 5.33144 7.47343 12.237 7.2495 8.72704 10.1589 numMergedOcc 0
17 mol 100 unq 7 iso 0 dist 8.96916 5.92158 6.45675 9.71692 9.71151 8.86688 12.237 7.2495 8.72704 15.9331 numMergedOcc 0
18 mol 100 unq 8 iso 0 dist 5.70279 5.92158 7.47343 8.96916 5.33144 6.45675 12.237 10.1589 8.72704 7.2495 numMergedOcc 0
19 mol 100 unq 9 iso 0 dist 5.70279 5.92158 7.47343 9.71692 10.1407 8.86688 12.237 10.1589 8.72704 15.9331 numMergedOcc 0
20 mol 115 unq 0 iso 0 dist 8.97043 11.8721 9.33865 12.9647 7.69052 5.83991 15.3564 10.7942 7.76729 10.9739 numMergedOcc 0
21 mol 115 unq 1 iso 0 dist 8.97043 5.19652 6.11741 12.9647 7.69052 7.88312 8.77794 10.8292 6.99777 11.7126 numMergedOcc 0
22 mol 115 unq 2 iso 0 dist 8.97043 5.19652 6.11741 12.9647 7.69052 7.88312 13.7249 6.12943 9.14376 4.62962 numMergedOcc 0
23 mol 117 unq 0 iso 0 dist 8.81172 5.34484 9.84395 11.6152 13.1058 7.90328 11.3437 11.3679 6.62561 4.91401 numMergedOcc 0
24 mol 142 unq 0 iso 0 dist 7.15087 8.68855 9.2313 10.5719 5.50998 7.73169 9.15112 9.49653 7.15475 7.53854 numMergedOcc 0
25 mol 142 unq 1 iso 0 dist 7.15087 8.68855 9.2313 15.3413 11.1395 8.96657 9.15112 9.49653 7.15475 10.3477 numMergedOcc 0
26 mol 142 unq 2 iso 0 dist 7.15087 5.50176 5.31024 10.5719 5.50998 7.26382 9.15112 9.49653 9.07935 7.53854 numMergedOcc 0
27 mol 155 unq 0 iso 0 dist 5.68636 7.92939 6.43582 12.7322 7.66392 7.46303 16.0761 12.1814 9.14392 6.3845 numMergedOcc 0
28 mol 155 unq 1 iso 0 dist 5.68636 7.92939 6.43582 12.7322 7.66392 7.46303 10.6429 6.34186 7.51198 5.86939 numMergedOcc 0
29 mol 156 unq 0 iso 0 dist 9.19499 5.66289 7.44554 7.11647 5.56175 8.94056 9.40225 7.29758 6.27641 8.67156 numMergedOcc 0
30 mol 156 unq 1 iso 0 dist 9.19499 5.66289 7.44554 13.581 8.38403 9.83699 9.40225 7.29758 6.27641 4.53931 numMergedOcc 0
31 mol 156 unq 2 iso 0 dist 7.11647 5.66289 8.94056 9.19499 5.56175 7.44554 9.40225 8.67156 6.27641 7.29758 numMergedOcc 0
32 mol 156 unq 3 iso 0 dist 7.11647 5.66289 8.94056 13.581 11.2719 9.83699 9.40225 8.67156 6.27641 4.53931 numMergedOcc 0
33 mol 156 unq 4 iso 0 dist 7.98018 4.68187 9.83699 10.0213 8.38403 7.44554 4.94012 4.53931 6.27641 7.29758 numMergedOcc 0
34 mol 156 unq 5 iso 0 dist 7.98018 4.68187 9.83699 11.8093 11.2719 8.94056 4.94012 4.53931 6.27641 8.67156 numMergedOcc 0
35 mol 181 unq 0 iso 0 dist 8.90247 5.114 9.1374 10.3907 8.88798 5.98885 9.30874 6.25083 6.94688 5.86342 numMergedOcc 0
36 mol 181 unq 1 iso 0 dist 8.90247 5.114 9.1374 10.3907 8.88798 5.98885 5.54873 4.77278 6.71012 9.14057 numMergedOcc 0
37 mol 181 unq 2 iso 0 dist 8.90247 5.114 9.1374 13.7299 12.1628 9.15386 9.30874 6.25083 6.94688 6.80228 numMergedOcc 0
38 mol 181 unq 3 iso 0 dist 8.90247 5.114 9.1374 13.7299 12.1628 9.15386 5.54873 4.77278 6.71012 11.6919 numMergedOcc 0
39 mol 205 unq 0 iso 0 dist 6.15806 10.6362 7.26832 12.9169 7.38516 6.03031 7.70781 6.23291 9.19704 8.66809 numMergedOcc 0
40 mol 205 unq 1 iso 0 dist 6.15806 10.6362 7.26832 17.5925 13.8543 7.80463 7.70781 6.23291 9.19704 13.231 numMergedOcc 0
41 mol 224 unq 0 iso 0 dist 9.73411 9.81806 6.57273 10.1632 5.0744 6.60589 14.0429 5.29877 6.65984 6.12232 numMergedOcc 0
42 mol 224 unq 1 iso 0 dist 7.07564 10.8463 6.57273 12.0295 5.0744 6.60589 10.7344 5.29877 6.65984 6.12232 numMergedOcc 0
43 mol 276 unq 0 iso 0 dist 8.79189 6.33662 6.87396 13.9936 6.88557 9.8993 13.3054 6.4102 8.76347 7.54851 numMergedOcc 0
