0 mol 11 unq 0 iso 0 dist 5.87616 6.27964 7.53641 6.29106 4.08268 5.15125 numMergedOcc 0
1 mol 11 unq 1 iso 0 dist 5.87616 6.27964 7.53641 7.05626 4.24301 10.9655 numMergedOcc 0
2 mol 30 unq 0 iso 0 dist 8.61226 8.51968 9.80682 7.27643 6.06435 4.97535 numMergedOcc 0
3 mol 58 unq 0 iso 0 dist 5.35101 6.89262 7.7624 8.80308 4.37642 10.5356 numMergedOcc 0
4 mol 58 unq 1 iso 0 dist 5.35101 7.93406 7.63046 8.80308 4.37642 6.64072 numMergedOcc 0
5 mol 131 unq 0 iso 0 dist 7.03774 9.58388 5.69278 8.9967 3.98821 6.63662 numMergedOcc 0
6 mol 131 unq 1 iso 0 dist 7.03774 6.77889 6.87651 8.9967 3.98821 6.14427 numMergedOcc 0
7 mol 133 unq 0 iso 0 dist 5.59311 9.18505 13.9116 9.68996 6.00816 18.7407 numMergedOcc 0
8 mol 133 unq 1 iso 0 dist 9.22456 9.18505 15.5016 9.68996 8.76048 18.7407 numMergedOcc 0
9 mol 133 unq 2 iso 0 dist 5.7232 9.18505 4.70999 9.68996 14.6925 18.7407 numMergedOcc 0
10 mol 186 unq 0 iso 0 dist 7.45384 9.4588 12.4341 7.77211 13.0423 10.7455 numMergedOcc 0
11 mol 236 unq 0 iso 0 dist 4.43243 6.02845 6.46022 7.87572 9.5878 5.87054 numMergedOcc 0
12 mol 236 unq 1 iso 0 dist 4.43243 9.35599 11.3284 7.87572 9.5878 8.11867 numMergedOcc 0
13 mol 236 unq 2 iso 0 dist 5.92025 6.02845 5.972 7.87572 5.55311 5.87054 numMergedOcc 0
14 mol 236 unq 3 iso 0 dist 5.92025 9.35599 10.9042 7.87572 5.55311 8.11867 numMergedOcc 0
15 mol 236 unq 4 iso 0 dist 9.04819 6.02845 5.91643 7.87572 4.28296 5.87054 numMergedOcc 0
16 mol 236 unq 5 iso 0 dist 9.04819 9.35599 4.72317 7.87572 4.28296 8.11867 numMergedOcc 0
17 mol 238 unq 0 iso 0 dist 8.92585 6.86905 14.946 6.62283 5.18265 11.9863 numMergedOcc 0
18 mol 238 unq 1 iso 0 dist 8.92585 6.86905 14.946 8.60978 4.30687 13.0383 numMergedOcc 0
19 mol 239 unq 0 iso 0 dist 6.84088 5.62744 7.04644 9.26512 15.9388 13.0625 numMergedOcc 0
20 mol 239 unq 1 iso 0 dist 6.84088 5.62744 7.04644 9.2495 5.38925 5.51771 numMergedOcc 0
21 mol 239 unq 2 iso 0 dist 6.84088 5.62744 7.04644 5.82804 4.22981 4.88461 numMergedOcc 0
22 mol 239 unq 3 iso 0 dist 6.84088 7.76984 4.99161 9.26512 15.9388 15.1473 numMergedOcc 0
23 mol 239 unq 4 iso 0 dist 6.84088 7.76984 4.99161 9.2495 5.38925 10.2355 numMergedOcc 0
24 mol 239 unq 5 iso 0 dist 6.84088 7.76984 4.99161 5.82804 4.22981 6.62656 numMergedOcc 0
25 mol 247 unq 0 iso 0 dist 8.28575 8.81684 8.96314 8.46644 4.11384 8.98161 numMergedOcc 0
26 mol 256 unq 0 iso 0 dist 9.36652 6.07677 8.22925 8.73597 7.61243 5.28199 numMergedOcc 0
27 mol 256 unq 1 iso 0 dist 7.54613 7.56605 8.22925 7.32198 7.61243 5.28199 numMergedOcc 0
28 mol 266 unq 0 iso 0 dist 6.86805 9.84057 7.00525 5.62193 6.00136 8.19557 numMergedOcc 0
29 mol 266 unq 1 iso 0 dist 6.86805 7.87939 10.8888 5.62193 6.00136 5.4894 numMergedOcc 0
