0 mol 7 unq 0 iso 0 dist 9.17764 4.68431 7.11539 17.5844 9.97624 15.5773 numMergedOcc 0
1 mol 12 unq 0 iso 0 dist 6.05244 13.7296 9.52857 5.12292 6.96422 14.8356 numMergedOcc 0
2 mol 46 unq 0 iso 0 dist 8.12513 4.9813 8.23202 10.2582 6.61977 9.39741 numMergedOcc 0
3 mol 46 unq 1 iso 0 dist 6.9762 12.8946 8.23202 4.92196 6.61977 9.39741 numMergedOcc 0
4 mol 48 unq 0 iso 0 dist 8.69823 8.05728 7.1796 11.8982 7.281 5.20585 numMergedOcc 0
5 mol 48 unq 1 iso 0 dist 8.69823 8.76375 9.16212 11.8982 7.281 9.98618 numMergedOcc 0
6 mol 128 unq 0 iso 0 dist 4.89256 7.31749 8.73383 5.21787 6.98158 5.53962 numMergedOcc 0
7 mol 130 unq 0 iso 0 dist 7.35647 14.7066 7.7461 9.17181 6.90634 8.88349 numMergedOcc 0
8 mol 130 unq 1 iso 0 dist 4.88366 10.7544 7.7461 8.0835 6.90634 8.88349 numMergedOcc 0
9 mol 146 unq 0 iso 0 dist 8.73563 10.7724 6.47434 6.21982 6.50043 5.03111 numMergedOcc 0
10 mol 146 unq 1 iso 0 dist 9.64915 10.4249 6.47434 5.91626 6.50043 5.03111 numMergedOcc 0
11 mol 173 unq 0 iso 0 dist 8.76228 12.523 8.14167 5.5203 6.64779 13.5257 numMergedOcc 0
12 mol 238 unq 0 iso 0 dist 6.97527 15.2293 9.49129 12.9488 8.90076 5.05275 numMergedOcc 0
13 mol 238 unq 1 iso 0 dist 6.97527 15.2293 9.49129 6.3161 6.87131 15.0682 numMergedOcc 0
14 mol 238 unq 2 iso 0 dist 6.97527 15.2293 9.49129 10.8926 8.09718 13.1727 numMergedOcc 0
15 mol 239 unq 0 iso 0 dist 9.94034 6.35573 5.95622 9.20205 5.88802 4.81796 numMergedOcc 0
16 mol 265 unq 0 iso 0 dist 7.87337 6.24185 9.68583 5.82541 5.40318 9.72334 numMergedOcc 0
17 mol 266 unq 0 iso 0 dist 8.38581 17.5836 9.34312 15.2731 9.71152 11.7017 numMergedOcc 0
18 mol 266 unq 1 iso 0 dist 8.38581 8.37091 7.53905 15.2731 9.71152 8.46837 numMergedOcc 0
19 mol 273 unq 0 iso 0 dist 6.59092 12.2394 8.83491 5.35494 8.85779 13.2599 numMergedOcc 0
20 mol 273 unq 1 iso 0 dist 6.59092 7.5139 9.02711 5.35494 8.85779 10.9195 numMergedOcc 0
