0 mol 7 unq 0 iso 0 dist 6.8464 4.65291 5.99459 10.1033 7.78327 7.00508 numMergedOcc 0
1 mol 38 unq 0 iso 0 dist 9.30722 6.31143 9.19165 9.57959 7.68478 5.08577 numMergedOcc 0
2 mol 72 unq 0 iso 0 dist 8.4143 6.53445 6.21799 3.63735 6.62699 4.38233 numMergedOcc 0
3 mol 72 unq 1 iso 0 dist 8.4143 6.27856 5.03251 3.63735 6.62699 5.62585 numMergedOcc 0
4 mol 72 unq 2 iso 0 dist 8.4143 11.2873 7.66093 3.63735 6.62699 9.84528 numMergedOcc 0
5 mol 72 unq 3 iso 0 dist 9.58834 6.27856 9.56773 3.63735 8.98867 5.62585 numMergedOcc 0
6 mol 85 unq 0 iso 0 dist 9.67557 11.3963 7.7068 4.21164 8.04242 11.1225 numMergedOcc 0
7 mol 122 unq 0 iso 0 dist 8.75778 4.06619 6.00603 6.39355 4.42563 3.17342 numMergedOcc 0
8 mol 127 unq 0 iso 0 dist 9.89053 4.0787 7.79505 10.6832 6.80627 11.1934 numMergedOcc 0
9 mol 129 unq 0 iso 0 dist 8.00624 9.82512 6.69691 6.61102 7.97548 9.74071 numMergedOcc 0
10 mol 129 unq 1 iso 0 dist 8.00624 9.82512 6.69691 9.0678 9.64164 6.92699 numMergedOcc 0
11 mol 129 unq 2 iso 0 dist 8.00624 6.31483 5.51197 6.61102 7.97548 9.87781 numMergedOcc 0
12 mol 129 unq 3 iso 0 dist 8.00624 6.31483 5.51197 9.0678 9.64164 9.93375 numMergedOcc 0
13 mol 129 unq 4 iso 0 dist 8.00624 14.6258 8.86944 6.61102 7.97548 13.8096 numMergedOcc 0
14 mol 129 unq 5 iso 0 dist 8.00624 14.6258 8.86944 9.0678 9.64164 11.221 numMergedOcc 0
15 mol 178 unq 0 iso 0 dist 9.63185 11.4463 9.11204 11.1931 4.72821 9.56928 numMergedOcc 0
16 mol 197 unq 0 iso 0 dist 8.67786 6.57766 9.10817 14.0686 9.23086 17.435 numMergedOcc 0
17 mol 197 unq 1 iso 0 dist 8.67786 12.3362 9.73548 14.0686 9.23086 4.91041 numMergedOcc 0
18 mol 205 unq 0 iso 0 dist 6.94789 6.16492 6.49765 10.5366 9.31158 6.49396 numMergedOcc 0
19 mol 205 unq 1 iso 0 dist 6.23932 9.99561 6.49765 9.27501 9.31158 6.49396 numMergedOcc 0
20 mol 241 unq 0 iso 0 dist 7.73213 10.7255 7.95042 9.91137 7.52531 6.7194 numMergedOcc 0
21 mol 277 unq 0 iso 0 dist 4.81916 9.31926 9.35539 9.21484 4.9764 13.2853 numMergedOcc 0
22 mol 277 unq 1 iso 0 dist 4.81916 9.31926 9.35539 10.3506 6.36559 12.4985 numMergedOcc 0
23 mol 277 unq 2 iso 0 dist 4.81916 13.1828 8.9682 9.21484 4.9764 5.9732 numMergedOcc 0
24 mol 277 unq 3 iso 0 dist 4.81916 13.1828 8.9682 10.3506 6.36559 8.61922 numMergedOcc 0
25 mol 277 unq 4 iso 0 dist 4.81916 10.6994 6.92711 9.21484 4.9764 3.79766 numMergedOcc 0
26 mol 277 unq 5 iso 0 dist 4.81916 10.6994 6.92711 10.3506 6.36559 7.07613 numMergedOcc 0
27 mol 287 unq 0 iso 0 dist 7.7743 5.06236 7.45616 5.13698 5.30118 3.66473 numMergedOcc 0
28 mol 288 unq 0 iso 0 dist 7.7743 5.06236 7.45616 5.13698 5.30118 3.66473 numMergedOcc 0
29 mol 289 unq 0 iso 0 dist 7.7743 5.06236 7.45616 5.13698 5.30118 3.66473 numMergedOcc 0
