0 mol 43 unq 0 iso 0 dist 6.79185 9.02471 11.9382 5.06502 8.92291 13.9823 numMergedOcc 0
1 mol 43 unq 1 iso 0 dist 6.79185 9.02471 11.9382 6.45462 8.37962 13.2795 numMergedOcc 0
2 mol 73 unq 0 iso 0 dist 6.43377 7.37171 12.7614 14.9342 9.33919 21.1182 numMergedOcc 0
3 mol 73 unq 1 iso 0 dist 6.43377 7.37171 12.7614 13.3558 9.79143 19.3924 numMergedOcc 0
4 mol 88 unq 0 iso 0 dist 6.066 9.07128 10.2678 5.57085 9.36032 10.3871 numMergedOcc 0
5 mol 88 unq 1 iso 0 dist 6.066 9.07128 10.2678 9.94966 8.3592 17.5257 numMergedOcc 0
6 mol 88 unq 2 iso 0 dist 6.066 6.65615 7.1811 5.57085 9.36032 5.07548 numMergedOcc 0
7 mol 88 unq 3 iso 0 dist 6.066 6.65615 7.1811 9.94966 8.3592 11.7451 numMergedOcc 0
8 mol 88 unq 4 iso 0 dist 9.36032 5.07548 7.1811 5.57085 6.066 6.65615 numMergedOcc 0
9 mol 88 unq 5 iso 0 dist 9.36032 5.07548 7.1811 10.9968 8.3592 11.7451 numMergedOcc 0
10 mol 88 unq 6 iso 0 dist 5.96359 7.74064 4.62877 13.5016 9.30559 12.9774 numMergedOcc 0
11 mol 88 unq 7 iso 0 dist 5.96359 7.74064 4.62877 4.96064 7.48974 11.1844 numMergedOcc 0
12 mol 88 unq 8 iso 0 dist 5.96359 7.74064 4.62877 8.62396 8.40428 12.3309 numMergedOcc 0
13 mol 88 unq 9 iso 0 dist 8.3592 7.74064 5.32715 9.94966 6.066 10.7263 numMergedOcc 0
14 mol 88 unq 10 iso 0 dist 8.3592 7.74064 5.32715 10.9968 9.36032 12.2051 numMergedOcc 0
15 mol 92 unq 0 iso 0 dist 7.48658 5.42067 7.43075 9.35561 7.20279 12.6375 numMergedOcc 0
16 mol 110 unq 0 iso 0 dist 6.2967 9.10911 7.95278 8.3284 9.11812 15.4375 numMergedOcc 0
17 mol 110 unq 1 iso 0 dist 6.2967 9.10911 7.95278 4.56913 6.78225 12.7232 numMergedOcc 0
18 mol 127 unq 0 iso 0 dist 5.72373 5.39356 3.76048 5.55757 7.20988 5.01504 numMergedOcc 0
19 mol 127 unq 1 iso 0 dist 5.72373 9.92746 12.308 5.55757 7.20988 12.7755 numMergedOcc 0
20 mol 127 unq 2 iso 0 dist 7.20988 5.01504 3.76048 5.55757 5.72373 5.39356 numMergedOcc 0
21 mol 157 unq 0 iso 0 dist 8.97404 8.10592 12.3126 12.4918 7.02823 18.3886 numMergedOcc 0
22 mol 206 unq 0 iso 0 dist 5.52084 4.51255 7.29429 7.73294 4.90825 8.65714 numMergedOcc 0
23 mol 213 unq 0 iso 0 dist 8.29133 8.82761 7.70759 5.45334 8.96646 4.66576 numMergedOcc 0
24 mol 213 unq 1 iso 0 dist 8.96646 9.09354 16.0616 5.45334 8.29133 10.5407 numMergedOcc 0
25 mol 213 unq 2 iso 0 dist 8.96646 4.66576 7.70759 5.45334 8.29133 8.82761 numMergedOcc 0
26 mol 219 unq 0 iso 0 dist 5.40597 9.64116 11.3881 7.02195 7.66784 15.8203 numMergedOcc 0
27 mol 219 unq 1 iso 0 dist 5.40597 9.64116 11.3881 13.4387 8.69579 19.4222 numMergedOcc 0
28 mol 219 unq 2 iso 0 dist 5.40597 9.64116 11.3881 10.8119 6.71733 17.4159 numMergedOcc 0
29 mol 248 unq 0 iso 0 dist 9.12664 9.64778 10.3077 5.86196 6.51383 11.1716 numMergedOcc 0
30 mol 274 unq 0 iso 0 dist 6.32856 9.83622 14.8955 9.15171 8.11169 15.5487 numMergedOcc 0
