0 mol 7 unq 0 iso 0 dist 6.36911 9.87885 7.92429 13.2247 9.36807 6.1206 6.28925 7.58143 5.35168 8.70159 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 7.31201 6.1206 4.40641 13.2247 10.672 9.87885 8.70159 8.50789 5.35168 6.28925 numMergedOcc 0
2 mol 7 unq 2 iso 0 dist 9.36807 6.1206 7.92429 13.2247 6.36911 9.87885 8.70159 7.58143 5.35168 6.28925 numMergedOcc 0
3 mol 72 unq 0 iso 0 dist 9.02278 6.21799 5.5067 8.24309 12.0903 7.12321 11.4456 11.0168 6.82436 8.96978 numMergedOcc 0
4 mol 72 unq 1 iso 0 dist 8.624 9.74228 9.88768 5.36766 6.77912 7.12321 11.9307 6.33215 6.82436 8.96978 numMergedOcc 0
5 mol 73 unq 0 iso 0 dist 8.70133 9.73086 6.15714 5.4148 4.65521 7.4369 9.33919 13.2106 10.4668 9.79143 numMergedOcc 0
6 mol 73 unq 1 iso 0 dist 4.65521 7.4369 6.15714 5.4148 8.70133 9.73086 9.79143 13.2106 10.4668 9.33919 numMergedOcc 0
7 mol 73 unq 2 iso 0 dist 7.13087 5.61588 8.97361 8.07446 13.6145 5.5087 9.83298 12.0765 4.25755 6.43377 numMergedOcc 0
8 mol 73 unq 3 iso 0 dist 7.13087 7.83244 10.2983 8.07446 13.6145 6.08682 9.83298 12.0765 6.08046 6.43377 numMergedOcc 0
9 mol 88 unq 0 iso 0 dist 9.10189 7.51139 8.40245 12.1547 11.375 7.80898 10.0313 5.51516 6.29943 6.066 numMergedOcc 0
10 mol 88 unq 1 iso 0 dist 8.66514 7.80898 7.15936 12.1547 14.3557 7.51139 9.87388 12.3777 9.68157 9.30559 numMergedOcc 0
11 mol 88 unq 2 iso 0 dist 9.25235 7.80898 10.8763 12.1547 17.4216 7.51139 9.87388 12.9635 9.68157 9.30559 numMergedOcc 0
12 mol 132 unq 0 iso 0 dist 7.61505 7.89457 6.545 4.35917 6.03703 6.89918 10.0208 6.73645 3.92897 7.19937 numMergedOcc 0
13 mol 134 unq 0 iso 0 dist 8.94837 9.00918 5.58312 14.069 11.0162 9.10524 12.2509 8.69502 4.20094 6.50009 numMergedOcc 0
14 mol 219 unq 0 iso 0 dist 4.87541 4.33238 3.78261 7.02195 10.105 7.83604 5.40597 7.57664 4.27314 7.66784 numMergedOcc 0
15 mol 225 unq 0 iso 0 dist 5.50387 8.1945 3.92979 13.3965 9.88956 6.50998 9.31373 7.96309 5.95485 9.88976 numMergedOcc 0
16 mol 234 unq 0 iso 0 dist 9.5707 7.81215 11.8229 10.2693 11.8897 5.64285 12.2772 13.7546 5.43679 9.07916 numMergedOcc 0
17 mol 234 unq 1 iso 0 dist 9.5707 7.81215 11.8229 10.2693 11.8897 5.64285 6.35438 10.0213 4.76962 9.57132 numMergedOcc 0
18 mol 234 unq 2 iso 0 dist 7.85175 7.81215 10.5304 10.2693 13.0678 5.64285 12.2772 11.9163 5.43679 9.07916 numMergedOcc 0
19 mol 234 unq 3 iso 0 dist 7.85175 7.81215 10.5304 10.2693 13.0678 5.64285 6.35438 6.81789 4.76962 9.57132 numMergedOcc 0
20 mol 234 unq 4 iso 0 dist 9.39181 5.64285 6.45373 10.2693 10.475 7.81215 9.57132 5.16504 4.76962 6.35438 numMergedOcc 0
21 mol 235 unq 0 iso 0 dist 7.32211 5.1823 4.47008 7.218 6.98084 8.19317 9.22081 6.12136 5.67913 7.48753 numMergedOcc 0
22 mol 235 unq 1 iso 0 dist 7.32211 5.70635 7.34601 7.218 6.98084 6.29377 9.22081 6.12136 4.80217 7.48753 numMergedOcc 0
