0 mol 30 unq 0 iso 0 dist 8.204 7.88072 3.90342 4.83638 9.11745 9.63882 numMergedOcc 0
1 mol 30 unq 1 iso 0 dist 8.204 7.88072 3.90342 5.2103 4.62145 6.87277 numMergedOcc 0
2 mol 48 unq 0 iso 0 dist 9.40644 7.99434 3.85292 8.12843 7.33788 4.22002 numMergedOcc 0
3 mol 48 unq 1 iso 0 dist 9.40644 7.99434 3.85292 9.72202 9.74351 8.10774 numMergedOcc 0
4 mol 48 unq 2 iso 0 dist 9.40644 7.99434 3.85292 12.7252 7.36877 6.5241 numMergedOcc 0
5 mol 48 unq 3 iso 0 dist 5.35252 7.99434 6.44604 8.12843 8.52681 4.22002 numMergedOcc 0
6 mol 48 unq 4 iso 0 dist 5.35252 7.99434 6.44604 9.72202 9.98769 8.10774 numMergedOcc 0
7 mol 48 unq 5 iso 0 dist 5.06188 8.10222 6.4561 9.57893 9.40291 8.14245 numMergedOcc 0
8 mol 48 unq 6 iso 0 dist 5.06188 8.10222 6.4561 7.88988 7.94814 4.17933 numMergedOcc 0
9 mol 48 unq 7 iso 0 dist 5.06188 8.10222 6.4561 8.00934 9.55632 5.54893 numMergedOcc 0
10 mol 63 unq 0 iso 0 dist 6.49343 7.85738 12.6017 4.44607 6.42443 9.13228 numMergedOcc 0
11 mol 76 unq 0 iso 0 dist 7.48127 5.91098 8.58474 11.6853 9.50939 7.66068 numMergedOcc 0
12 mol 78 unq 0 iso 0 dist 6.54194 9.39265 3.63624 3.74336 6.13394 9.2057 numMergedOcc 0
13 mol 78 unq 1 iso 0 dist 9.86325 6.11101 7.86077 7.38398 7.50229 8.61143 numMergedOcc 0
14 mol 83 unq 0 iso 0 dist 7.2118 7.69755 4.48523 4.12785 5.13041 7.50925 numMergedOcc 0
15 mol 90 unq 0 iso 0 dist 9.06641 8.63446 6.65219 4.77556 7.01987 5.24346 numMergedOcc 0
16 mol 92 unq 0 iso 0 dist 7.70612 8.01266 4.51052 4.65353 9.62106 8.55237 numMergedOcc 0
17 mol 143 unq 0 iso 0 dist 5.40826 5.33772 3.66518 5.08025 6.38786 4.3855 numMergedOcc 0
18 mol 230 unq 0 iso 0 dist 9.24729 8.01593 3.86973 4.45276 9.62914 9.47092 numMergedOcc 0
19 mol 256 unq 0 iso 0 dist 6.45473 6.33954 5.16057 6.51471 9.49634 5.58222 numMergedOcc 0
20 mol 266 unq 0 iso 0 dist 9.0836 6.48382 7.63149 7.52317 6.39822 8.25286 numMergedOcc 0
21 mol 266 unq 1 iso 0 dist 9.0836 6.48382 7.63149 9.52953 5.36518 9.9965 numMergedOcc 0
22 mol 266 unq 2 iso 0 dist 9.62494 6.48382 4.39553 5.79323 9.90506 6.96692 numMergedOcc 0
23 mol 266 unq 3 iso 0 dist 9.62494 6.48382 4.39553 7.52317 8.61077 8.25286 numMergedOcc 0
24 mol 266 unq 4 iso 0 dist 9.62494 6.48382 4.39553 9.52953 9.11585 9.9965 numMergedOcc 0
25 mol 268 unq 0 iso 0 dist 5.94741 7.40323 6.07203 5.39453 5.49906 9.52476 numMergedOcc 0
26 mol 277 unq 0 iso 0 dist 8.15119 4.1545 9.21484 5.11865 9.07744 7.98956 numMergedOcc 0
27 mol 277 unq 1 iso 0 dist 8.15119 4.25172 10.3506 5.11865 9.07744 5.86185 numMergedOcc 0
