0 mol 148 unq 0 iso 0 dist 6.17633 9.64123 5.34721 4.52591 9.32264 11.8523 numMergedOcc 0
1 mol 150 unq 0 iso 0 dist 6.20295 9.72257 5.38822 4.62267 9.34249 11.8819 numMergedOcc 0
2 mol 158 unq 0 iso 0 dist 6.06276 8.45117 8.38978 9.62817 7.47948 15.613 numMergedOcc 0
3 mol 168 unq 0 iso 0 dist 8.66519 7.53748 12.8964 18.276 9.63035 21.3651 numMergedOcc 0
4 mol 168 unq 1 iso 0 dist 8.66519 7.53748 12.8964 13.9418 7.19585 17.0339 numMergedOcc 0
5 mol 168 unq 2 iso 0 dist 8.66519 7.53748 12.8964 4.23264 8.35731 11.3669 numMergedOcc 0
6 mol 186 unq 0 iso 0 dist 7.17789 5.47189 12.5982 6.61246 7.78385 10.4931 numMergedOcc 0
7 mol 220 unq 0 iso 0 dist 9.66105 6.9028 8.22716 7.55696 9.70552 9.99923 numMergedOcc 0
8 mol 228 unq 0 iso 0 dist 8.53297 9.46214 7.05573 14.0604 9.23333 13.3344 numMergedOcc 0
9 mol 228 unq 1 iso 0 dist 8.53297 9.46214 7.05573 12.1944 7.24491 13.6633 numMergedOcc 0
10 mol 228 unq 2 iso 0 dist 8.53297 9.46214 7.05573 8.69492 6.02491 12.4731 numMergedOcc 0
11 mol 228 unq 3 iso 0 dist 9.23333 8.81885 7.8494 14.0604 8.53297 13.2654 numMergedOcc 0
12 mol 228 unq 4 iso 0 dist 9.23333 8.81885 7.8494 5.68894 7.24491 11.4734 numMergedOcc 0
13 mol 228 unq 5 iso 0 dist 9.23333 8.81885 7.8494 10.4472 6.02491 13.2124 numMergedOcc 0
14 mol 228 unq 6 iso 0 dist 6.02491 9.51602 5.84747 8.69492 8.53297 12.4243 numMergedOcc 0
15 mol 228 unq 7 iso 0 dist 6.02491 9.51602 5.84747 10.4472 9.23333 14.0858 numMergedOcc 0
16 mol 228 unq 8 iso 0 dist 6.02491 9.51602 5.84747 5.57968 7.24491 11.5512 numMergedOcc 0
17 mol 228 unq 9 iso 0 dist 9.21065 8.89311 8.07826 6.03543 7.65917 12.1595 numMergedOcc 0
18 mol 228 unq 10 iso 0 dist 9.21065 8.89311 8.07826 10.2557 5.89577 13.2541 numMergedOcc 0
19 mol 228 unq 11 iso 0 dist 9.21065 8.89311 8.07826 14.053 8.6694 13.4745 numMergedOcc 0
20 mol 228 unq 12 iso 0 dist 5.89577 9.46214 5.70777 10.2557 9.21065 13.9612 numMergedOcc 0
21 mol 228 unq 13 iso 0 dist 5.89577 9.46214 5.70777 5.57478 7.65917 11.7314 numMergedOcc 0
22 mol 228 unq 14 iso 0 dist 5.89577 9.46214 5.70777 8.69492 8.6694 12.4731 numMergedOcc 0
23 mol 228 unq 15 iso 0 dist 8.6694 9.51602 7.18261 14.053 9.21065 13.3655 numMergedOcc 0
24 mol 228 unq 16 iso 0 dist 8.6694 9.51602 7.18261 12.6444 7.65917 14.2596 numMergedOcc 0
25 mol 228 unq 17 iso 0 dist 8.6694 9.51602 7.18261 8.69492 5.89577 12.4243 numMergedOcc 0
26 mol 271 unq 0 iso 0 dist 7.90629 7.59727 7.30308 6.83746 9.01599 12.8073 numMergedOcc 0
27 mol 277 unq 0 iso 0 dist 6.92271 6.86014 5.77904 10.7983 8.62666 5.97073 numMergedOcc 0
28 mol 277 unq 1 iso 0 dist 8.62666 5.97073 5.77904 10.7983 6.92271 6.86014 numMergedOcc 0
29 mol 294 unq 0 iso 0 dist 8.92737 6.45955 6.99988 3.83551 7.15278 5.71661 numMergedOcc 0
30 mol 294 unq 1 iso 0 dist 8.92737 8.86937 11.8346 3.83551 7.15278 8.98536 numMergedOcc 0
31 mol 294 unq 2 iso 0 dist 7.15278 5.71661 6.99988 3.83551 8.92737 6.45955 numMergedOcc 0
32 mol 294 unq 3 iso 0 dist 7.15278 8.98536 11.8346 3.83551 8.92737 8.86937 numMergedOcc 0
