0 mol 8 unq 0 iso 0 dist 4.92734 7.97177 8.53529 13.8619 12.4076 7.03958 15.8335 16.4393 8.07902 7.92414 numMergedOcc 0
1 mol 8 unq 1 iso 0 dist 4.92734 7.97177 8.53529 13.8619 12.4076 7.03958 9.91124 7.3915 5.65816 6.82379 numMergedOcc 0
2 mol 8 unq 2 iso 0 dist 6.4754 5.3298 7.18019 10.2567 10.9495 7.03958 8.79934 13.6835 8.07902 7.92414 numMergedOcc 0
3 mol 8 unq 3 iso 0 dist 6.4754 5.3298 7.18019 10.2567 10.9495 7.03958 10.9476 10.6335 5.65816 6.82379 numMergedOcc 0
4 mol 8 unq 4 iso 0 dist 6.4754 5.3298 7.18019 11.9453 8.4069 8.53529 10.9476 10.6335 5.65816 7.3915 numMergedOcc 0
5 mol 8 unq 5 iso 0 dist 6.57999 7.97177 7.18019 13.8619 10.9495 7.03958 15.8335 13.6835 8.07902 7.92414 numMergedOcc 0
6 mol 8 unq 6 iso 0 dist 6.57999 7.97177 7.18019 13.8619 10.9495 7.03958 9.91124 10.6335 5.65816 6.82379 numMergedOcc 0
7 mol 8 unq 7 iso 0 dist 6.57999 7.97177 7.18019 4.92734 8.4069 8.53529 9.91124 10.6335 5.65816 7.3915 numMergedOcc 0
8 mol 8 unq 8 iso 0 dist 7.3795 5.3298 8.44009 10.2567 8.09332 7.03958 8.79934 11.2464 8.07902 7.92414 numMergedOcc 0
9 mol 8 unq 9 iso 0 dist 7.3795 5.3298 8.44009 10.2567 8.09332 7.03958 10.9476 11.7258 5.65816 6.82379 numMergedOcc 0
10 mol 8 unq 10 iso 0 dist 7.3795 5.3298 8.44009 11.9453 12.9016 8.53529 10.9476 11.7258 5.65816 7.3915 numMergedOcc 0
11 mol 9 unq 0 iso 0 dist 9.16444 5.86578 7.32257 11.4615 6.14147 6.55811 8.33201 10.8213 4.58685 7.9944 numMergedOcc 0
12 mol 9 unq 1 iso 0 dist 9.16444 5.86578 7.32257 13.4922 10.5747 8.64915 8.33201 10.8213 4.58685 7.032 numMergedOcc 0
13 mol 25 unq 0 iso 0 dist 6.23095 12.1434 8.6653 11.9439 10.6808 7.92503 6.06832 5.81959 6.61233 6.90155 numMergedOcc 0
14 mol 26 unq 0 iso 0 dist 7.46207 5.63833 6.46104 12.0856 7.96502 7.36856 10.2375 10.4035 5.30297 8.6385 numMergedOcc 0
15 mol 98 unq 0 iso 0 dist 5.85841 4.81103 5.78706 7.00285 10.6225 5.59328 10.8678 14.2622 8.53212 5.88354 numMergedOcc 0
16 mol 98 unq 1 iso 0 dist 5.85841 4.81103 5.78706 11.8527 12.7411 7.5242 10.8678 14.2622 8.53212 5.74854 numMergedOcc 0
17 mol 98 unq 2 iso 0 dist 6.78839 7.22196 5.78706 8.02354 10.6225 5.59328 13.5865 14.2622 8.53212 5.88354 numMergedOcc 0
18 mol 98 unq 3 iso 0 dist 6.78839 7.22196 5.78706 13.7128 12.7411 7.5242 13.5865 14.2622 8.53212 5.74854 numMergedOcc 0
19 mol 98 unq 4 iso 0 dist 7.00285 4.81103 5.59328 11.8527 7.72877 7.5242 10.8678 5.88354 8.53212 5.74854 numMergedOcc 0
20 mol 98 unq 5 iso 0 dist 8.02354 7.22196 5.59328 13.7128 7.72877 7.5242 13.5865 5.88354 8.53212 5.74854 numMergedOcc 0
21 mol 119 unq 0 iso 0 dist 8.62648 9.25614 6.52773 11.5266 4.85907 9.11344 8.9683 8.56342 6.96805 7.99857 numMergedOcc 0
22 mol 171 unq 0 iso 0 dist 7.13441 8.99392 8.24693 12.2067 7.31409 5.93786 6.15895 5.10618 6.29877 7.71426 numMergedOcc 0
23 mol 171 unq 1 iso 0 dist 7.13441 5.68701 6.71356 12.2067 7.31409 8.1344 6.15895 5.10618 5.90358 7.71426 numMergedOcc 0
24 mol 195 unq 0 iso 0 dist 8.3705 11.3703 9.26504 15.8199 10.7531 7.36683 9.80071 7.62942 6.0634 6.60567 numMergedOcc 0
25 mol 238 unq 0 iso 0 dist 5.67917 5.11183 7.57812 12.6253 10.0191 9.24557 6.85179 6.66971 4.77308 7.32982 numMergedOcc 0
26 mol 278 unq 0 iso 0 dist 8.83775 4.36832 8.00673 7.58272 8.29447 6.62841 12.325 12.4198 13.537 7.67245 numMergedOcc 0
