0 mol 5 unq 0 iso 0 dist 8.70824 4.42081 8.97274 10.7757 3.99762 9.83318 5.2392 11.3755 9.22027 13.345 numMergedOcc 0
1 mol 5 unq 1 iso 0 dist 5.93404 4.42081 7.5815 10.7757 8.19993 9.83318 5.2392 5.90479 9.22027 13.345 numMergedOcc 0
2 mol 53 unq 0 iso 0 dist 7.94701 5.07389 5.63499 13.1423 12.2389 8.79235 10.47 7.73958 5.40489 5.38541 numMergedOcc 0
3 mol 76 unq 0 iso 0 dist 9.33989 6.69911 6.55112 7.25561 6.6711 8.12959 14.5265 6.38237 9.59729 10.3042 numMergedOcc 0
4 mol 76 unq 1 iso 0 dist 8.57953 3.94216 6.55112 8.97499 6.6711 8.12959 13.12 6.38237 9.59729 10.3042 numMergedOcc 0
5 mol 79 unq 0 iso 0 dist 5.55798 6.35003 6.30814 9.25766 9.88522 7.7288 9.55191 4.0291 8.7515 12.4136 numMergedOcc 0
6 mol 157 unq 0 iso 0 dist 8.78412 12.5289 6.07906 19.3854 11.1291 8.8201 11.5255 5.43167 8.40821 9.49026 numMergedOcc 0
7 mol 181 unq 0 iso 0 dist 5.13534 4.76079 5.97971 11.8366 8.66115 8.39573 11.1594 8.70425 9.92831 10.7348 numMergedOcc 0
8 mol 195 unq 0 iso 0 dist 9.35664 6.61517 6.65077 13.9542 10.5362 7.75518 9.48766 6.04748 6.396 7.83764 numMergedOcc 0
9 mol 205 unq 0 iso 0 dist 5.81277 11.8763 9.79826 17.6147 18.2651 9.867 10.867 9.99561 5.03818 9.78747 numMergedOcc 0
10 mol 205 unq 1 iso 0 dist 5.81277 11.8763 9.79826 17.6147 18.2651 9.867 17.881 15.2328 6.40171 10.1599 numMergedOcc 0
11 mol 205 unq 2 iso 0 dist 8.47833 6.10058 7.53734 13.3777 17.3532 9.867 6.41148 10.1222 5.03818 9.78747 numMergedOcc 0
12 mol 205 unq 3 iso 0 dist 8.47833 6.10058 7.53734 13.3777 17.3532 9.867 12.239 10.4922 6.40171 10.1599 numMergedOcc 0
13 mol 205 unq 4 iso 0 dist 5.05912 6.10058 9.79826 13.3777 18.2651 9.867 6.41148 9.99561 5.03818 9.78747 numMergedOcc 0
14 mol 205 unq 5 iso 0 dist 5.05912 6.10058 9.79826 13.3777 18.2651 9.867 12.239 15.2328 6.40171 10.1599 numMergedOcc 0
15 mol 205 unq 6 iso 0 dist 5.47586 3.50446 7.53734 12.8036 17.3532 9.867 5.06713 10.1222 5.03818 9.78747 numMergedOcc 0
16 mol 205 unq 7 iso 0 dist 5.47586 3.50446 7.53734 12.8036 17.3532 9.867 8.69512 10.4922 6.40171 10.1599 numMergedOcc 0
17 mol 205 unq 8 iso 0 dist 6.60429 3.50446 9.79826 12.8036 18.2651 9.867 5.06713 9.99561 5.03818 9.78747 numMergedOcc 0
18 mol 205 unq 9 iso 0 dist 6.60429 3.50446 9.79826 12.8036 18.2651 9.867 8.69512 15.2328 6.40171 10.1599 numMergedOcc 0
19 mol 225 unq 0 iso 0 dist 6.97662 9.92088 8.69052 6.22332 4.37243 7.50697 15.1504 12.7959 6.46405 10.685 numMergedOcc 0
20 mol 238 unq 0 iso 0 dist 5.83514 3.68226 5.52788 11.8266 7.18715 9.67281 6.96382 4.70535 4.66186 5.36582 numMergedOcc 0
