0 mol 7 unq 0 iso 0 dist 8.41585 5.99972 12.0193 7.78327 13.5229 3.54153 6.06176 6.36911 10.6471 13.2302 numMergedOcc 0
1 mol 19 unq 0 iso 0 dist 4.51865 6.41423 4.64838 7.7312 4.44441 5.31883 4.69858 6.20943 5.82366 6.38574 numMergedOcc 0
2 mol 19 unq 1 iso 0 dist 6.864 6.41423 4.97119 7.7312 10.0411 5.31883 11.4401 8.78293 13.1234 17.3652 numMergedOcc 0
3 mol 19 unq 2 iso 0 dist 6.864 6.41423 4.97119 7.7312 10.0411 5.31883 12.3093 8.23643 11.3136 15.6781 numMergedOcc 0
4 mol 19 unq 3 iso 0 dist 6.864 6.41423 4.97119 7.7312 10.0411 5.31883 4.69858 7.82528 5.82366 6.38574 numMergedOcc 0
5 mol 58 unq 0 iso 0 dist 7.32874 7.21955 7.12541 9.4278 10.7675 4.97525 6.75888 6.40841 8.71468 13.2217 numMergedOcc 0
6 mol 58 unq 1 iso 0 dist 6.86465 9.92355 5.78774 9.23438 4.59417 8.76454 5.92889 9.58673 13.7654 8.98478 numMergedOcc 0
7 mol 58 unq 2 iso 0 dist 6.35756 7.68678 5.78774 7.17488 4.59417 8.76454 7.05413 9.58673 13.7654 8.98478 numMergedOcc 0
8 mol 58 unq 3 iso 0 dist 9.55426 7.21955 5.74871 9.4278 10.5901 4.97525 13.1021 9.73139 14.2645 19.1225 numMergedOcc 0
9 mol 58 unq 4 iso 0 dist 9.55426 7.21955 5.74871 9.4278 10.5901 4.97525 6.75888 6.31428 8.71468 13.2217 numMergedOcc 0
10 mol 72 unq 0 iso 0 dist 9.96708 9.27838 11.6378 4.86198 10.7434 13.6186 9.0131 7.321 13.1462 10.3769 numMergedOcc 0
11 mol 75 unq 0 iso 0 dist 7.79912 9.81166 11.4997 9.16597 4.74027 7.98253 10.0425 5.15851 13.1026 7.30467 numMergedOcc 0
12 mol 85 unq 0 iso 0 dist 6.19965 7.54568 8.09967 8.04242 8.18948 13.5973 11.6116 9.47876 11.8261 16.5125 numMergedOcc 0
13 mol 85 unq 1 iso 0 dist 7.66905 7.54568 4.65335 8.04242 14.113 13.5973 11.6116 7.22293 11.8261 16.5125 numMergedOcc 0
14 mol 102 unq 0 iso 0 dist 7.36792 8.31932 7.42011 5.54256 3.48119 7.28191 5.498 9.94856 13.2332 7.68537 numMergedOcc 0
15 mol 181 unq 0 iso 0 dist 7.81386 5.94469 7.77758 8.29467 6.13927 3.63671 6.7991 4.93785 7.05653 6.91878 numMergedOcc 0
16 mol 181 unq 1 iso 0 dist 7.63312 5.94469 12.5387 8.29467 13.2274 3.63671 4.80231 6.93764 10.6207 13.0606 numMergedOcc 0
17 mol 205 unq 0 iso 0 dist 7.26832 5.44002 10.3603 7.13783 13.3822 4.76454 6.23291 9.19704 10.5073 12.4189 numMergedOcc 0
18 mol 235 unq 0 iso 0 dist 5.4638 9.55668 7.60081 8.08965 4.75609 6.82702 4.65302 8.21247 7.95766 9.11149 numMergedOcc 0
19 mol 274 unq 0 iso 0 dist 8.49997 9.85289 11.4459 9.83622 7.38951 5.14522 6.8406 7.97444 14.7249 12.6363 numMergedOcc 0
