0 mol 5 unq 0 iso 0 dist 9.83318 3.99762 8.97274 12.7073 12.8419 9.17088 numMergedOcc 0
1 mol 43 unq 0 iso 0 dist 9.04117 4.22382 6.57633 12.8044 6.43237 9.21978 numMergedOcc 0
2 mol 43 unq 1 iso 0 dist 9.04117 4.22382 6.57633 10.9455 8.6477 8.03754 numMergedOcc 0
3 mol 43 unq 2 iso 0 dist 6.34215 8.43173 6.57633 12.7268 6.43237 9.21978 numMergedOcc 0
4 mol 43 unq 3 iso 0 dist 6.34215 8.43173 6.57633 10.2065 8.6477 8.03754 numMergedOcc 0
5 mol 54 unq 0 iso 0 dist 9.87963 11.0441 8.73588 8.62769 4.02037 9.20429 numMergedOcc 0
6 mol 54 unq 1 iso 0 dist 8.67352 9.19015 8.73588 6.09782 4.02037 9.20429 numMergedOcc 0
7 mol 67 unq 0 iso 0 dist 6.44825 4.94708 9.83555 8.64208 13.625 9.2223 numMergedOcc 0
8 mol 76 unq 0 iso 0 dist 8.12959 6.6711 6.55112 11.272 5.31985 7.46657 numMergedOcc 0
9 mol 152 unq 0 iso 0 dist 9.21757 4.57152 7.94976 11.0227 7.68889 8.41774 numMergedOcc 0
10 mol 152 unq 1 iso 0 dist 6.75471 10.0143 7.94976 10.2576 7.68889 8.41774 numMergedOcc 0
11 mol 155 unq 0 iso 0 dist 5.55218 5.55092 8.99128 8.66709 7.10286 8.57712 numMergedOcc 0
12 mol 162 unq 0 iso 0 dist 6.51243 7.51816 9.65468 9.42819 5.65603 7.69229 numMergedOcc 0
13 mol 168 unq 0 iso 0 dist 7.96541 8.66083 8.18217 11.6738 4.67135 8.41715 numMergedOcc 0
14 mol 168 unq 1 iso 0 dist 7.96541 8.66083 8.18217 14.9056 9.87321 7.79893 numMergedOcc 0
15 mol 181 unq 0 iso 0 dist 8.39573 8.66115 5.97971 13.3844 5.71898 7.7544 numMergedOcc 0
16 mol 195 unq 0 iso 0 dist 7.75518 10.5362 6.65077 14.2773 8.04534 7.04524 numMergedOcc 0
17 mol 205 unq 0 iso 0 dist 9.867 18.2651 9.79826 14.4261 8.97813 6.23932 numMergedOcc 0
18 mol 217 unq 0 iso 0 dist 6.58871 7.49329 8.99484 5.10683 4.64118 6.23025 numMergedOcc 0
19 mol 224 unq 0 iso 0 dist 9.09697 13.611 7.71863 20.9762 16.3431 8.80858 numMergedOcc 0
20 mol 238 unq 0 iso 0 dist 9.67281 7.18715 5.52788 11.7876 7.06793 4.80834 numMergedOcc 0
21 mol 279 unq 0 iso 0 dist 7.03656 7.77606 8.30375 5.17586 8.4236 9.24472 numMergedOcc 0
