0 mol 11 unq 0 iso 0 dist 6.40513 4.54105 5.96346 9.33059 4.10106 6.859 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 6.85331 15.2995 9.01567 15.6713 8.91183 6.19899 numMergedOcc 0
2 mol 24 unq 1 iso 0 dist 6.85331 15.2995 9.01567 19.4859 13.0212 8.49709 numMergedOcc 0
3 mol 24 unq 2 iso 0 dist 6.85331 12.8157 7.29868 15.6713 8.91183 6.61696 numMergedOcc 0
4 mol 24 unq 3 iso 0 dist 6.85331 12.8157 7.29868 8.14598 5.69214 5.80953 numMergedOcc 0
5 mol 24 unq 4 iso 0 dist 6.35095 10.9987 6.73939 20.5403 15.4313 9.85784 numMergedOcc 0
6 mol 24 unq 5 iso 0 dist 6.35095 10.9987 6.73939 19.5233 14.1829 9.87996 numMergedOcc 0
7 mol 25 unq 0 iso 0 dist 8.23292 14.4951 7.45383 14.1443 6.47509 5.20109 numMergedOcc 0
8 mol 41 unq 0 iso 0 dist 4.68793 8.68242 8.51663 11.959 13.4019 6.21128 numMergedOcc 0
9 mol 119 unq 0 iso 0 dist 6.85677 5.00632 6.73586 10.7143 4.39676 8.67537 numMergedOcc 0
10 mol 143 unq 0 iso 0 dist 7.5984 11.4055 7.78652 9.33882 4.78563 5.06564 numMergedOcc 0
11 mol 143 unq 1 iso 0 dist 7.5984 9.54731 8.91301 9.33882 4.78563 7.5373 numMergedOcc 0
12 mol 155 unq 0 iso 0 dist 8.66709 12.1461 6.53347 5.55218 7.10286 9.24038 numMergedOcc 0
13 mol 171 unq 0 iso 0 dist 6.01711 6.4423 9.61462 9.67711 7.5383 7.47964 numMergedOcc 0
14 mol 181 unq 0 iso 0 dist 9.63295 14.1039 5.9176 17.7213 10.6474 8.12266 numMergedOcc 0
15 mol 181 unq 1 iso 0 dist 9.63295 14.1039 5.9176 11.1521 5.12833 9.43306 numMergedOcc 0
16 mol 181 unq 2 iso 0 dist 9.63295 14.1039 5.9176 12.519 4.61184 8.59681 numMergedOcc 0
17 mol 181 unq 3 iso 0 dist 9.63295 5.39949 6.41453 8.39573 5.93724 5.99437 numMergedOcc 0
18 mol 181 unq 4 iso 0 dist 9.63295 5.39949 6.41453 11.1521 5.12833 8.4848 numMergedOcc 0
19 mol 186 unq 0 iso 0 dist 7.45401 6.0361 8.73217 14.1366 10.8286 9.99396 numMergedOcc 0
20 mol 188 unq 0 iso 0 dist 7.95028 6.58929 7.14503 14.5916 9.71636 8.66624 numMergedOcc 0
21 mol 212 unq 0 iso 0 dist 7.87125 7.05237 8.69988 10.7857 3.9436 9.10288 numMergedOcc 0
22 mol 212 unq 1 iso 0 dist 7.87125 11.3998 8.55903 10.7857 3.9436 6.19798 numMergedOcc 0
23 mol 222 unq 0 iso 0 dist 8.69148 8.56453 7.67576 13.422 6.84862 8.43195 numMergedOcc 0
24 mol 222 unq 1 iso 0 dist 8.69148 8.56453 7.67576 15.096 9.53117 8.23406 numMergedOcc 0
25 mol 231 unq 0 iso 0 dist 9.98232 11.1156 7.79066 14.0384 4.15084 9.60504 numMergedOcc 0
26 mol 232 unq 0 iso 0 dist 7.47238 15.5413 9.05071 12.6118 5.42461 6.59036 numMergedOcc 0
27 mol 273 unq 0 iso 0 dist 6.54753 7.10817 8.83865 8.66133 4.24707 7.85836 numMergedOcc 0
28 mol 273 unq 1 iso 0 dist 6.54753 7.10817 8.83865 10.7274 8.56043 6.35532 numMergedOcc 0
29 mol 274 unq 0 iso 0 dist 9.81087 13.6675 7.46394 9.71389 5.22914 7.77765 numMergedOcc 0
30 mol 274 unq 1 iso 0 dist 9.81087 13.6675 7.46394 22.2821 14.7507 9.65868 numMergedOcc 0
31 mol 274 unq 2 iso 0 dist 9.79674 7.28382 8.91672 11.8611 16.5034 7.77765 numMergedOcc 0
32 mol 274 unq 3 iso 0 dist 9.79674 7.28382 8.91672 16.4504 12.5615 9.65868 numMergedOcc 0
